data_1kx7_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 1kx7 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.529 0.151 0 N-CA-C 110.548 -0.167 . . . . 10.0 110.548 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -145.02 122.8 11.89 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.987 -0.745 . . . . 10.0 108.987 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -53.86 -39.14 65.41 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.12 0.968 . . . . 10.0 112.573 172.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -58.67 -47.42 84.53 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 110.277 -0.268 . . . . 10.0 110.277 171.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.34 -31.78 72.28 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.426 -0.796 . . . . 10.0 110.688 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.5 mm -66.32 -50.98 63.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-O 118.442 -0.789 . . . . 10.0 110.145 176.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.18 -43.13 78.85 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 117.891 -1.524 . . . . 10.0 111.233 178.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.96 -22.57 64.11 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.376 1.47 . . . . 10.0 112.593 -175.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt -91.35 -31.57 16.02 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.408 -0.807 . . . . 10.0 113.178 168.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.48 -65.93 1.11 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.453 1.024 . . . . 10.0 112.506 -169.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.88 40.18 0.14 Allowed 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.088 1.355 . . . . 10.0 111.176 177.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.8 t -123.37 3.45 9.11 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 125.252 1.421 . . . . 10.0 113.779 -165.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 40.8 t -105.98 -46.83 8.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 124.234 1.013 . . . . 10.0 108.597 -174.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.6 m -91.01 -63.98 1.19 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 126.595 1.958 . . . . 10.0 111.471 177.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -73.32 -22.93 60.22 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.493 1.117 . . . . 10.0 113.977 -165.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.67 -53.74 54.82 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.157 0.983 . . . . 10.0 110.543 179.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 37.5 mmt -102.1 -23.8 14.02 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.402 1.081 . . . . 10.0 112.135 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.15 49.12 2.92 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 124.25 0.929 . . . . 10.0 112.04 -175.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 79.3 t -93.77 161.39 2.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.29 1.436 . . . . 10.0 109.397 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.07 18.9 6.76 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.456 1.102 . . . . 10.0 113.436 -174.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.3 18.43 76.23 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 124.566 1.079 . . . . 10.0 113.209 -173.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.56 145.53 90.19 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 118.525 1.162 . . . . 10.0 113.725 -172.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.88 137.21 17.47 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 125.047 3.832 . . . . 10.0 110.02 -177.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.24 139.69 58.8 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 123.95 0.9 . . . . 10.0 112.567 -163.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.5 p -51.31 -32.53 25.51 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.508 1.123 . . . . 10.0 113.249 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -134.2 115.34 14.06 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.694 1.197 . . . . 10.0 109.369 171.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -154.58 166.18 34.14 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 125.521 1.528 . . . . 10.0 108.425 176.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 56.5 m -110.13 -36.01 5.95 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 117.776 0.262 . . . . 10.0 111.637 168.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.49 -21.41 35.52 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.305 -0.872 . . . . 10.0 113.268 -176.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -78.67 -30.56 46.25 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.769 2.028 . . . . 10.0 109.528 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.422 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 65.1 m95 -92.67 -35.42 13.51 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 126.546 1.939 . . . . 10.0 111.849 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -43.18 -56.84 5.95 Favored Pre-proline 0 CA--C 1.549 0.94 0 N-CA-C 115.087 1.514 . . . . 10.0 115.087 175.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -67.95 -7.51 19.92 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.739 2.293 . . . . 10.0 113.413 -179.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -93.42 -51.62 4.89 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.684 1.194 . . . . 10.0 109.061 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.77 8.78 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.868 1.667 . . . . 10.0 115.257 169.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.34 -37.92 14.53 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.977 0.911 . . . . 10.0 109.443 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -93.05 -38.72 11.48 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.01 0.924 . . . . 10.0 111.313 176.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 157.29 -143.56 9.69 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 111.325 -0.71 . . . . 10.0 111.325 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.9 t -127.04 -60.45 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 C-N-CA 123.734 0.814 . . . . 10.0 110.608 -176.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -44.96 -33.55 2.06 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.369 1.868 . . . . 10.0 113.653 176.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -48.34 -24.3 1.18 Allowed 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.101 1.36 . . . . 10.0 113.687 173.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -94.74 -47.04 6.65 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 125.431 1.492 . . . . 10.0 111.387 177.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -51.96 -34.73 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 CA-C-N 119.434 1.015 . . . . 10.0 111.943 172.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -67.62 -44.01 79.03 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.525 -1.36 . . . . 10.0 112.627 169.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.5 m -64.08 -43.0 96.77 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.153 -0.967 . . . . 10.0 110.306 -177.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 7.6 p -65.64 -48.84 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 124.268 1.027 . . . . 10.0 111.634 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.59 -31.93 72.83 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.471 0.653 . . . . 10.0 110.828 176.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.3 m -74.04 -33.91 63.9 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.464 -0.772 . . . . 10.0 112.445 176.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 89.01 113.89 1.31 Allowed Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.587 -1.005 . . . . 10.0 110.587 -169.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.29 -170.03 0.9 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.985 0.514 . . . . 10.0 109.873 165.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -66.58 -57.02 8.11 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 119.904 -1.747 . . . . 10.0 111.745 -172.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.68 1.69 28.99 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 113.76 -1.564 . . . . 10.0 112.397 176.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 43.4 mtp -109.67 140.73 22.46 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 112.788 0.662 . . . . 10.0 112.788 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.9 149.19 65.68 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.65 1.567 . . . . 10.0 110.679 174.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -65.58 104.91 0.7 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.38 2.72 . . . . 10.0 110.155 -179.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 110.7 22.44 6.35 Favored Glycine 0 CA--C 1.525 0.7 0 CA-C-O 118.813 -0.993 . . . . 10.0 113.093 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 50.77 33.28 27.14 Favored Glycine 0 CA--C 1.535 1.286 0 CA-C-N 119.222 1.511 . . . . 10.0 114.477 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 6.0 ttm 60.2 29.87 19.37 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.866 1.667 . . . . 10.0 112.764 -176.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.6 -177.91 3.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.576 1.95 . . . . 10.0 110.171 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.5 t -145.99 -67.62 0.29 Allowed 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.582 -0.699 . . . . 10.0 110.72 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -105.41 31.22 5.08 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.671 1.188 . . . . 10.0 110.899 -176.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 64.8 m -88.92 114.07 25.15 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.768 1.227 . . . . 10.0 111.017 -172.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.4 p -86.3 151.18 23.8 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.433 0.693 . . . . 10.0 110.359 -174.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.79 -35.48 10.12 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 114.059 1.133 . . . . 10.0 114.059 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -49.28 -55.76 11.67 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.537 0.608 . . . . 10.0 111.348 171.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -76.29 -37.01 58.08 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.543 -0.723 . . . . 10.0 110.928 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -52.95 63.14 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 122.043 0.925 . . . . 10.0 111.115 -179.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.4 mmmm -64.87 -46.42 81.88 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 124.961 1.305 . . . . 10.0 108.96 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.94 -34.85 60.82 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 174.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.32 -43.5 70.16 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.644 -1.285 . . . . 10.0 111.279 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.23 -44.71 96.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 123.713 0.805 . . . . 10.0 112.051 169.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -76.1 -28.07 57.4 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.763 -1.211 . . . . 10.0 111.681 -175.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -46.87 -50.0 19.35 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.818 0.818 . . . . 10.0 110.716 170.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 72.2 mtm -68.46 -47.78 66.23 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.394 -0.821 . . . . 10.0 111.513 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 t -163.92 -87.41 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.353 0.661 . . . . 10.0 111.298 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt 172.43 53.15 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.825 2.05 . . . . 10.0 110.433 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.55 -85.27 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 114.025 1.12 . . . . 10.0 114.025 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.422 ' HE2' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.612 1.565 . . . . 10.0 115.072 -173.803 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 . . . . . 0 N--CA 1.457 -0.097 0 N-CA-C 112.621 0.6 . . . . 10.0 112.621 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -148.91 116.66 6.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.667 0.746 . . . . 10.0 110.207 176.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.41 -33.06 19.44 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 113.139 0.792 . . . . 10.0 113.139 171.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -55.26 -50.61 69.03 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 118.29 0.496 . . . . 10.0 110.906 169.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.85 -34.21 75.08 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.296 0.638 . . . . 10.0 110.785 -177.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.2 mm -65.57 -51.84 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 118.47 -0.776 . . . . 10.0 109.381 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.35 -40.47 81.52 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 120.211 1.369 . . . . 10.0 111.249 -178.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -68.68 -22.25 64.38 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.461 1.504 . . . . 10.0 112.615 -178.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.49 -29.54 16.94 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.038 -1.039 . . . . 10.0 113.502 167.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -106.62 -66.34 1.02 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.742 1.217 . . . . 10.0 112.442 -168.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.67 41.1 0.4 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.962 1.705 . . . . 10.0 109.771 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.8 t -123.21 4.09 9.21 Favored 'General case' 0 N--CA 1.461 0.084 0 C-N-CA 124.485 1.114 . . . . 10.0 112.997 -166.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.7 t -107.0 -53.68 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 C-N-CA 125.097 1.359 . . . . 10.0 108.676 -173.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.6 m -81.43 -62.18 1.73 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.609 1.163 . . . . 10.0 111.629 174.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -73.59 -19.34 60.9 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.967 1.307 . . . . 10.0 114.097 -164.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 t -64.92 -46.5 81.4 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.731 0.812 . . . . 10.0 111.032 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.8 mmt -104.56 -27.28 11.97 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.277 1.431 . . . . 10.0 111.88 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.38 52.8 1.8 Allowed Glycine 0 CA--C 1.533 1.174 0 C-N-CA 124.845 1.212 . . . . 10.0 112.156 -176.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 40.9 t -96.11 161.33 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.75 1.22 . . . . 10.0 109.786 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.23 16.89 5.25 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.083 1.353 . . . . 10.0 113.755 -176.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 74.95 25.52 69.05 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 123.858 0.742 . . . . 10.0 112.843 -172.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.25 141.56 91.53 Favored Pre-proline 0 CA--C 1.537 0.468 0 CA-C-N 118.384 1.092 . . . . 10.0 112.846 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -68.66 145.24 62.97 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 124.08 3.186 . . . . 10.0 110.754 177.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.6 mtpt -73.75 143.39 46.11 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.116 0.413 . . . . 10.0 112.116 -168.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.9 p -57.37 -26.03 60.39 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.119 0.968 . . . . 10.0 113.222 175.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -132.91 105.73 7.28 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.139 0.976 . . . . 10.0 109.338 171.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -147.09 157.98 43.79 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 106.898 -1.519 . . . . 10.0 106.898 173.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.1 t -104.31 -36.09 7.73 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.03 0.377 . . . . 10.0 110.876 166.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.03 -19.19 52.09 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.313 -1.492 . . . . 10.0 113.97 -176.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -89.75 -23.0 21.9 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.654 1.582 . . . . 10.0 110.398 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.515 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 49.4 m95 -97.82 -32.51 11.67 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.834 1.254 . . . . 10.0 110.591 178.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -44.14 -58.17 5.25 Favored Pre-proline 0 CA--C 1.542 0.646 0 N-CA-C 114.615 1.339 . . . . 10.0 114.615 172.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.47 6.85 2.1 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.685 2.257 . . . . 10.0 113.612 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -110.8 -42.51 4.0 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.866 1.666 . . . . 10.0 108.777 178.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.18 2.18 1.26 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.465 1.906 . . . . 10.0 114.232 170.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.0 14.57 28.7 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.539 1.136 . . . . 10.0 110.61 177.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 24.9 mmtt -125.42 -61.96 1.24 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.104 1.362 . . . . 10.0 110.606 173.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.422 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 172.09 -125.44 1.18 Allowed Glycine 0 CA--C 1.53 0.994 0 N-CA-C 110.321 -1.111 . . . . 10.0 110.321 -177.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.434 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -146.81 -55.74 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.299 0 C-N-CA 123.992 0.917 . . . . 10.0 110.6 -179.103 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.13 26.62 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.303 1.441 . . . . 10.0 113.995 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.434 ' H ' ' C ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -102.78 -49.21 3.87 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.318 1.847 . . . . 10.0 107.208 177.527 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.6 mp -80.18 -35.05 36.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.634 -172.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.1 p -59.06 -23.76 25.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 124.841 1.257 . . . . 10.0 112.362 171.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -78.88 -44.89 21.84 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.359 -0.838 . . . . 10.0 111.321 171.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.22 -42.05 99.21 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.47 -0.769 . . . . 10.0 110.285 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.33 -48.2 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 122.901 0.48 . . . . 10.0 110.845 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -33.96 76.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.981 0.42 . . . . 10.0 110.325 177.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.0 m -73.41 -28.94 62.27 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.867 0.691 . . . . 10.0 112.867 175.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.79 119.43 1.42 Allowed Glycine 0 CA--C 1.529 0.918 0 CA-C-N 119.271 0.941 . . . . 10.0 111.126 -172.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.8 tp -78.49 -146.09 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 123.918 0.887 . . . . 10.0 110.241 171.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -82.11 -64.06 1.26 Allowed 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.003 -1.686 . . . . 10.0 111.048 -175.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.84 -7.86 56.26 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.677 1.191 . . . . 10.0 112.521 174.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.5 mtp -97.05 135.34 22.02 Favored Pre-proline 0 CA--C 1.538 0.501 0 N-CA-C 113.073 0.768 . . . . 10.0 113.073 178.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.03 157.09 55.16 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.189 1.926 . . . . 10.0 110.635 175.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.54 101.83 0.46 Allowed 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.233 2.622 . . . . 10.0 109.989 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 118.7 -0.15 15.51 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 123.681 0.658 . . . . 10.0 112.909 -172.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 75.71 -48.51 2.29 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 118.78 1.29 . . . . 10.0 112.667 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -174.44 -37.21 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.995 2.118 . . . . 10.0 111.366 166.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -79.25 177.44 8.83 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.947 0.721 . . . . 10.0 112.947 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 t -128.1 -60.67 1.13 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.998 1.319 . . . . 10.0 111.215 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.35 54.01 1.92 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.586 1.154 . . . . 10.0 111.393 -177.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 18.8 m -110.03 125.72 53.22 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.452 1.501 . . . . 10.0 111.372 -177.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 30.2 m -112.89 137.13 51.72 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.86 1.264 . . . . 10.0 109.776 -177.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -35.31 -46.18 0.35 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.775 2.03 . . . . 10.0 114.055 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -28.92 -64.29 0.1 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.341 1.856 . . . . 10.0 112.733 165.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -90.17 -34.19 15.94 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.284 0.633 . . . . 10.0 111.724 177.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.58 -44.69 56.91 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 120.707 -1.246 . . . . 10.0 112.487 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.16 -48.17 53.37 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.639 0.776 . . . . 10.0 110.6 174.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.2 -30.6 7.19 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.473 0.545 . . . . 10.0 112.473 172.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.97 -34.36 57.58 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.539 1.136 . . . . 10.0 111.53 -178.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -75.0 -52.87 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.519 1.128 . . . . 10.0 110.115 175.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -64.87 -25.71 68.01 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.513 0.725 . . . . 10.0 112.665 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -40.45 -48.08 2.71 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 121.75 0.786 . . . . 10.0 112.085 169.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.8 mpp? -74.68 -49.34 21.66 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.489 -0.778 . . . . 10.0 112.539 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.446 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 5.5 t -152.72 -89.91 0.05 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.787 -0.625 . . . . 10.0 110.208 175.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 169.17 54.96 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.812 1.645 . . . . 10.0 110.001 -176.039 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -167.22 -87.72 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.328 1.051 . . . . 10.0 113.08 173.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.515 ' HE3' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.285 -0.864 . . . . 10.0 112.414 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 . . . . . 0 N--CA 1.46 0.058 0 N-CA-C 112.028 0.381 . . . . 10.0 112.028 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -139.66 120.36 14.29 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 121.533 0.683 . . . . 10.0 109.463 171.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.24 -36.32 30.6 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.723 0.809 . . . . 10.0 113.089 171.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -59.64 -45.67 91.31 Favored 'General case' 0 C--N 1.343 0.309 0 O-C-N 121.972 -0.455 . . . . 10.0 110.622 171.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.05 -31.97 72.0 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.53 -0.731 . . . . 10.0 111.05 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.2 mm -65.32 -51.78 60.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 O-C-N 121.397 -0.814 . . . . 10.0 108.904 175.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.413 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.15 -42.28 76.18 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 117.87 -1.532 . . . . 10.0 111.905 -178.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.83 -22.0 64.26 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.466 1.506 . . . . 10.0 112.443 -177.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -92.04 -29.1 16.76 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.829 1.048 . . . . 10.0 113.829 168.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.91 -64.93 1.22 Allowed 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.218 1.007 . . . . 10.0 112.394 -170.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.413 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.56 40.63 0.18 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.222 1.409 . . . . 10.0 111.232 178.429 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.4 t -126.9 -4.09 6.4 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 124.805 1.242 . . . . 10.0 114.101 -165.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.4 t -97.29 -40.58 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-O 122.456 1.122 . . . . 10.0 108.426 -175.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.3 m -104.06 -61.09 1.48 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 126.765 2.026 . . . . 10.0 109.631 -173.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -74.27 -16.7 60.94 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.537 1.31 . . . . 10.0 114.537 -169.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.0 m -69.81 -44.91 69.05 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.692 0.797 . . . . 10.0 110.893 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 tpt -115.05 -30.66 6.29 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.318 1.047 . . . . 10.0 113.039 -175.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.38 61.4 1.81 Allowed Glycine 0 CA--C 1.535 1.342 0 C-N-CA 125.533 1.539 . . . . 10.0 113.183 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 67.2 t -81.8 -57.13 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.951 -0.735 . . . . 10.0 112.056 -175.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.75 35.4 0.51 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.066 0.947 . . . . 10.0 110.725 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 58.64 27.35 61.24 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 124.686 1.136 . . . . 10.0 113.094 -173.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.52 138.19 96.77 Favored Pre-proline 0 CA--C 1.547 0.863 0 O-C-N 122.042 -0.681 . . . . 10.0 111.943 -177.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -68.67 149.7 73.81 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 123.35 2.7 . . . . 10.0 111.025 -174.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -70.29 137.6 50.84 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.212 -0.93 . . . . 10.0 112.374 -161.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.4 m -51.53 -25.48 6.74 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.263 1.209 . . . . 10.0 114.263 172.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 -142.5 91.14 2.29 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.637 0.775 . . . . 10.0 110.632 174.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -128.07 171.15 12.14 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.64 1.176 . . . . 10.0 109.166 170.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.6 m -105.36 -33.28 8.23 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 119.37 -0.348 . . . . 10.0 110.925 163.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.91 -38.66 61.77 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.904 -1.122 . . . . 10.0 113.852 -176.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -66.79 -31.02 71.38 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.744 0.783 . . . . 10.0 110.072 177.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.458 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 64.4 m95 -91.79 -34.42 14.59 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.33 2.252 . . . . 10.0 111.982 -171.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -41.16 -61.98 1.17 Allowed Pre-proline 0 CA--C 1.546 0.816 0 N-CA-C 114.094 1.146 . . . . 10.0 114.094 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -71.26 8.79 1.02 Allowed 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 123.08 2.52 . . . . 10.0 114.006 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -113.36 -51.45 2.81 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.019 1.728 . . . . 10.0 108.448 -178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -21.8 66.65 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.601 1.96 . . . . 10.0 112.053 173.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -79.64 -27.96 40.9 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.153 0.981 . . . . 10.0 110.057 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -76.41 -54.45 6.72 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.226 0.61 . . . . 10.0 109.936 174.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.449 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 162.5 -113.61 0.57 Allowed Glycine 0 CA--C 1.53 0.997 0 N-CA-C 111.167 -0.773 . . . . 10.0 111.167 176.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.428 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.1 OUTLIER -144.09 -57.97 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.31 0 C-N-CA 124.201 1.0 . . . . 10.0 110.572 176.743 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.89 6.73 0.15 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.007 1.723 . . . . 10.0 113.537 -174.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.449 HD22 ' N ' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -93.34 -17.87 23.07 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 125.467 1.507 . . . . 10.0 110.702 -178.459 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -106.4 -40.78 5.49 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.907 0.883 . . . . 10.0 110.949 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.9 p -52.16 -35.0 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 CA-C-O 121.087 0.47 . . . . 10.0 110.532 170.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.6 ptmt -62.28 -46.36 89.14 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.815 1.043 . . . . 10.0 113.815 171.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 64.0 m -67.09 -32.56 73.79 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 120.886 -1.134 . . . . 10.0 110.287 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.3 t -58.15 -58.02 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 122.839 0.456 . . . . 10.0 111.004 172.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -31.47 63.79 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.73 0.641 . . . . 10.0 112.73 175.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.71 -32.07 67.39 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 122.848 0.459 . . . . 10.0 112.097 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 79.13 94.4 0.31 Allowed Glycine 0 CA--C 1.532 1.117 0 N-CA-C 111.473 -0.651 . . . . 10.0 111.473 -174.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.5 tp -63.17 168.85 3.89 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.854 -0.792 . . . . 10.0 111.355 175.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -48.56 -57.64 5.88 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.953 -1.092 . . . . 10.0 113.043 -171.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.15 21.48 8.82 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.421 1.488 . . . . 10.0 112.473 174.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 39.3 ttp -126.71 129.64 24.02 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 114.313 1.227 . . . . 10.0 114.313 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -63.15 158.03 46.31 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.481 2.121 . . . . 10.0 112.155 177.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -58.96 135.71 68.5 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.703 2.269 . . . . 10.0 110.263 -179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.38 16.11 64.54 Favored Glycine 0 CA--C 1.527 0.841 0 O-C-N 121.742 -0.599 . . . . 10.0 113.872 -174.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 55.63 34.59 60.65 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 118.523 1.162 . . . . 10.0 112.285 -176.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 77.58 44.97 0.08 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.367 1.867 . . . . 10.0 112.529 -176.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.2 t -100.46 152.03 20.85 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.095 1.358 . . . . 10.0 110.901 171.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.5 p -108.78 -88.14 0.49 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.315 1.046 . . . . 10.0 110.132 164.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -106.14 74.93 1.07 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 126.53 1.932 . . . . 10.0 108.1 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -124.61 139.59 53.73 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.464 1.106 . . . . 10.0 110.514 174.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 93.6 m -111.43 153.16 26.51 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.845 1.258 . . . . 10.0 110.148 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -34.45 -45.02 0.21 Allowed 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 127.332 2.253 . . . . 10.0 114.54 176.272 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -41.19 -56.88 2.25 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 119.317 0.962 . . . . 10.0 113.518 170.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.12 -42.73 22.98 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.005 1.322 . . . . 10.0 112.739 175.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -55.25 -47.56 75.26 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.073 -1.017 . . . . 10.0 112.05 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 ptmm? -68.58 -52.21 34.24 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 108.442 -0.948 . . . . 10.0 108.442 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.75 -34.55 39.88 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.119 0.567 . . . . 10.0 112.36 177.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -64.2 -50.14 69.26 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.827 0.851 . . . . 10.0 109.811 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 8.9 mt -62.24 -44.15 98.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.181 0.993 . . . . 10.0 111.921 172.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -57.1 -37.92 72.62 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.303 1.441 . . . . 10.0 111.91 175.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -49.47 -43.41 45.04 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.476 0.547 . . . . 10.0 112.476 177.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.458 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -73.29 -69.83 0.4 Allowed 'General case' 0 CA--C 1.537 0.479 0 O-C-N 122.163 -0.336 . . . . 10.0 111.078 179.702 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.1 t -167.27 46.67 0.06 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.625 0.77 . . . . 10.0 111.807 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 37.88 60.71 1.15 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.471 1.508 . . . . 10.0 114.125 175.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -162.31 -82.0 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 113.232 0.827 . . . . 10.0 113.232 177.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.434 ' O ' ' NZ ' ' A' ' 78' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.13 0 N-CA-C 114.74 1.385 . . . . 10.0 114.74 -173.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.531 0.248 0 N-CA-C 113.514 0.931 . . . . 10.0 113.514 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -151.49 115.16 4.88 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.526 0.731 . . . . 10.0 109.415 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -38.42 -43.77 0.86 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.943 1.697 . . . . 10.0 113.749 167.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -60.84 -48.08 83.43 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 117.983 0.356 . . . . 10.0 111.1 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.61 -30.89 71.28 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.509 -0.744 . . . . 10.0 110.461 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -65.63 -52.72 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-O 118.916 -0.564 . . . . 10.0 109.534 176.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.15 -40.48 78.17 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 118.161 -1.416 . . . . 10.0 110.858 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -68.66 -21.93 64.42 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.85 1.66 . . . . 10.0 112.738 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.82 -27.25 14.01 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 113.447 0.906 . . . . 10.0 113.447 168.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -103.46 -67.73 0.87 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.198 0.999 . . . . 10.0 112.409 -174.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.54 38.73 0.19 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.276 1.43 . . . . 10.0 111.001 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -120.39 -4.67 9.89 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 124.669 1.188 . . . . 10.0 113.782 -166.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.3 t -100.09 -40.95 8.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.346 1.058 . . . . 10.0 109.167 -169.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 m -99.46 -61.26 1.39 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.292 2.237 . . . . 10.0 110.903 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -73.44 -22.78 60.11 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.181 0.993 . . . . 10.0 113.542 -167.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.4 t -61.63 -52.48 64.17 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.573 0.749 . . . . 10.0 110.989 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -101.42 -22.38 14.57 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.328 1.051 . . . . 10.0 111.775 -179.213 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.04 52.78 2.67 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.702 1.144 . . . . 10.0 111.956 -175.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 59.7 t -96.68 160.18 2.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 125.262 1.425 . . . . 10.0 109.494 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 60.68 18.6 8.66 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.197 0.999 . . . . 10.0 113.486 -176.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 82.12 3.89 90.42 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 124.082 0.849 . . . . 10.0 113.444 -173.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.49 146.28 64.86 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-N 118.164 0.982 . . . . 10.0 113.394 -174.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -70.5 155.33 63.71 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 123.73 2.954 . . . . 10.0 109.723 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -68.95 139.68 55.06 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 119.825 -0.75 . . . . 10.0 111.573 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -32.24 -45.34 0.11 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.848 2.059 . . . . 10.0 113.45 169.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -139.28 102.14 4.42 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.004 0.922 . . . . 10.0 109.191 170.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -118.03 157.92 25.93 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.059 -1.46 . . . . 10.0 107.059 170.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 92.9 m -103.79 -35.49 8.18 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.519 0.6 . . . . 10.0 111.279 171.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.82 -23.64 36.35 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.102 -0.999 . . . . 10.0 113.269 -178.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.411 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 33.0 t0 -87.62 -22.3 24.82 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.072 1.749 . . . . 10.0 110.517 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -95.39 -35.59 11.68 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.06 1.744 . . . . 10.0 110.803 177.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -40.14 -59.54 1.8 Allowed Pre-proline 0 N--CA 1.476 0.825 0 N-CA-C 114.248 1.203 . . . . 10.0 114.248 170.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.05 17.51 0.33 Allowed 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 123.379 2.719 . . . . 10.0 113.925 -179.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.83 -43.49 2.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.426 1.89 . . . . 10.0 110.336 168.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.1 -13.02 5.73 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.536 1.934 . . . . 10.0 112.488 174.052 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.62 24.18 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.586 1.155 . . . . 10.0 110.513 176.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -77.01 -52.21 9.74 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.144 -0.688 . . . . 10.0 109.144 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.42 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 157.66 -116.61 0.73 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.545 1.069 . . . . 10.0 110.594 175.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.463 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -149.02 -55.82 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.314 1.046 . . . . 10.0 110.331 174.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.76 28.88 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.265 1.026 . . . . 10.0 113.515 -177.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.463 ' H ' ' C ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -101.53 -56.3 2.33 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 128.053 2.541 . . . . 10.0 107.217 176.607 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.65 -26.41 32.18 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.71 -0.662 . . . . 10.0 111.161 -172.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -57.17 -22.6 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 125.578 1.551 . . . . 10.0 111.767 166.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.9 mmpt? -80.62 -38.27 29.56 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.227 0.611 . . . . 10.0 111.728 169.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.84 -37.7 64.75 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 120.471 -1.393 . . . . 10.0 110.874 -176.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 10.7 p -61.79 -42.46 94.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.246 1.018 . . . . 10.0 110.544 173.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -35.81 76.71 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.143 0.497 . . . . 10.0 109.683 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 28.0 m -73.05 -34.34 66.22 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.153 -0.967 . . . . 10.0 111.88 177.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.54 115.65 3.72 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.457 -1.057 . . . . 10.0 110.457 -168.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.02 -152.9 0.06 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 167.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -81.51 -60.69 2.17 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.652 -1.28 . . . . 10.0 110.428 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.09 -7.21 59.2 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.448 1.499 . . . . 10.0 112.335 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.72 142.59 25.3 Favored Pre-proline 0 N--CA 1.468 0.442 0 N-CA-C 112.236 0.458 . . . . 10.0 112.236 177.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.66 148.0 71.04 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.376 2.051 . . . . 10.0 110.753 175.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -66.67 110.22 1.83 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.216 2.611 . . . . 10.0 109.825 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 91.52 35.9 6.74 Favored Glycine 0 C--N 1.338 0.688 0 CA-C-O 119.617 -0.546 . . . . 10.0 111.872 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 28.94 39.38 0.02 OUTLIER Glycine 0 CA--C 1.535 1.33 0 C-N-CA 127.365 2.412 . . . . 10.0 115.661 -172.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 62.83 -0.85 0.52 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.844 2.057 . . . . 10.0 115.793 -174.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.6 p -94.02 -29.07 15.4 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.608 1.163 . . . . 10.0 112.541 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 96.7 m 65.54 -71.34 0.08 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.149 1.38 . . . . 10.0 111.97 -178.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -79.63 54.52 1.81 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.22 1.408 . . . . 10.0 109.962 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -94.0 117.28 29.89 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.637 1.175 . . . . 10.0 109.307 -174.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 90.9 m -116.34 129.1 56.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.029 -1.101 . . . . 10.0 108.029 -174.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -37.39 -41.45 0.43 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.93 1.692 . . . . 10.0 112.533 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -35.42 -57.36 0.61 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 114.245 1.202 . . . . 10.0 114.245 169.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -91.94 -34.98 14.26 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.188 0.904 . . . . 10.0 111.25 173.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.95 -42.2 85.66 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.5 -1.375 . . . . 10.0 112.559 -170.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -42.73 99.9 Favored 'General case' 0 C--O 1.222 -0.35 0 O-C-N 121.353 -0.842 . . . . 10.0 109.909 174.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.39 -28.8 69.52 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.351 1.06 . . . . 10.0 111.999 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.64 -46.38 38.58 Favored 'General case' 0 C--O 1.223 -0.341 0 O-C-N 121.007 -1.058 . . . . 10.0 109.604 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -61.45 -46.65 96.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 121.514 0.673 . . . . 10.0 111.407 170.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . 0.256 0.0 OUTLIER -59.63 -35.38 74.26 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 121.491 -0.756 . . . . 10.0 112.185 -177.866 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -44.61 -41.14 6.36 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.34 0.867 . . . . 10.0 113.34 178.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.72 -67.5 0.69 Allowed 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.113 -0.367 . . . . 10.0 111.713 -177.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.0 t -164.07 33.81 0.08 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.696 0.798 . . . . 10.0 112.479 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt 38.23 61.27 1.14 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.863 1.265 . . . . 10.0 114.172 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -149.49 -55.57 0.18 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.073 0.949 . . . . 10.0 112.806 -178.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.411 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.2 0 C-N-CA 125.97 1.708 . . . . 10.0 112.134 -171.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.348 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -139.87 121.53 15.3 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 124.697 1.199 . . . . 10.0 107.996 172.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -44.84 -41.0 6.68 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.114 1.366 . . . . 10.0 113.363 168.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -59.51 -47.27 86.15 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.053 -0.405 . . . . 10.0 110.901 171.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.17 -31.3 70.76 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.705 -0.622 . . . . 10.0 111.123 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.3 mt -64.44 -53.12 46.66 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 N-CA-C 107.981 -1.118 . . . . 10.0 107.981 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.69 -41.58 75.24 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 117.836 -1.545 . . . . 10.0 112.085 -177.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.78 -21.8 64.32 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.299 1.839 . . . . 10.0 112.566 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.65 -28.56 15.29 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.291 0.848 . . . . 10.0 113.291 168.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -108.05 -64.67 1.19 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.173 0.989 . . . . 10.0 112.652 -170.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.1 41.74 0.3 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.911 1.285 . . . . 10.0 110.552 178.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.2 t -126.82 4.04 6.65 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.556 1.142 . . . . 10.0 113.507 -165.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.9 t -109.75 -53.76 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 C-N-CA 125.175 1.39 . . . . 10.0 108.676 -172.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.9 m -79.31 -64.31 1.22 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.856 1.262 . . . . 10.0 110.422 173.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -73.81 -10.39 59.62 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.152 1.781 . . . . 10.0 115.058 -165.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 t -72.01 -48.18 46.57 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.92 0.488 . . . . 10.0 109.968 178.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.3 tpt -106.59 -41.07 5.36 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.155 0.982 . . . . 10.0 112.439 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 96.25 62.47 0.96 Allowed Glycine 0 CA--C 1.536 1.376 0 C-N-CA 125.495 1.522 . . . . 10.0 112.666 -175.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 95.3 t -82.41 -55.99 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 O-C-N 121.854 -0.792 . . . . 10.0 112.027 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.94 32.92 0.43 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.064 0.946 . . . . 10.0 111.079 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 66.33 16.66 65.21 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 124.635 1.112 . . . . 10.0 113.442 -173.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.29 141.46 96.23 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 113.4 0.889 . . . . 10.0 113.4 -174.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.58 138.56 38.68 Favored 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 124.764 3.642 . . . . 10.0 110.717 -176.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.4 mttm -69.32 138.54 53.86 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 121.715 -0.616 . . . . 10.0 111.157 -168.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.6 t -47.46 -36.95 10.8 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.076 0.769 . . . . 10.0 113.076 175.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -119.8 73.72 0.98 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.646 1.578 . . . . 10.0 111.889 179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -117.74 159.8 22.4 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.046 -1.034 . . . . 10.0 109.757 171.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 57.6 m -108.33 -35.9 6.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.5 0.32 . . . . 10.0 111.39 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.01 -23.32 31.01 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 121.699 -0.625 . . . . 10.0 112.363 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -80.19 -33.86 37.88 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.859 1.663 . . . . 10.0 109.769 178.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.484 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 58.4 m95 -86.41 -35.33 19.8 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.039 1.736 . . . . 10.0 111.772 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -39.61 -59.69 1.56 Allowed Pre-proline 0 CA--C 1.548 0.887 0 O-C-N 120.272 -1.518 . . . . 10.0 114.762 172.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -75.06 15.46 0.74 Allowed 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.617 2.878 . . . . 10.0 113.528 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.425 ' C ' ' H ' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -116.57 -45.45 2.8 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.531 1.932 . . . . 10.0 108.176 177.609 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 mt -58.18 0.35 0.07 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 127.623 2.369 . . . . 10.0 114.208 168.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.425 ' H ' ' C ' ' A' ' 34' ' ' ARG . . . -84.04 -29.12 27.14 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.218 1.407 . . . . 10.0 110.076 177.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -94.61 -64.68 1.05 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.865 0.866 . . . . 10.0 109.359 -179.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 129.51 119.97 2.2 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 124.184 0.897 . . . . 10.0 112.127 171.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.6 m -38.59 116.06 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 114.214 1.19 . . . . 10.0 114.214 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 138.23 -19.99 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 130.142 3.377 . . . . 10.0 110.819 -169.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.09 -57.51 3.75 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.436 1.017 . . . . 10.0 109.985 172.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.2 mp -76.7 -24.06 53.12 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.52 -0.737 . . . . 10.0 111.76 -168.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -60.15 -27.37 38.99 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 O-C-N 121.686 -0.634 . . . . 10.0 110.829 170.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.9 mmpt? -67.53 -45.84 74.56 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.347 -0.845 . . . . 10.0 110.761 171.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.9 m -62.08 -36.57 82.08 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.174 -0.953 . . . . 10.0 110.155 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.2 t -58.84 -54.13 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 121.065 0.46 . . . . 10.0 111.177 175.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -33.92 71.67 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.325 0.491 . . . . 10.0 112.325 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 58.7 m -71.56 -27.48 63.19 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.696 0.799 . . . . 10.0 112.852 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 76.67 91.93 0.23 Allowed Glycine 0 CA--C 1.53 0.985 0 CA-C-N 119.336 0.971 . . . . 10.0 112.27 -174.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.94 167.99 1.43 Allowed 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 122.056 0.932 . . . . 10.0 111.419 171.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.44 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 13.7 m-80 -53.66 -55.3 27.21 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.515 -1.365 . . . . 10.0 112.417 -172.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.15 19.93 2.94 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 113.862 -1.517 . . . . 10.0 112.573 174.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.0 ttp -136.15 134.94 20.49 Favored Pre-proline 0 CA--C 1.546 0.802 0 N-CA-C 114.769 1.396 . . . . 10.0 114.769 -175.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.14 147.66 73.48 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 120.965 1.11 . . . . 10.0 111.553 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -61.5 132.61 41.51 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.251 2.634 . . . . 10.0 109.853 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.65 15.05 81.88 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 119.711 -1.233 . . . . 10.0 112.76 -172.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.09 34.63 6.03 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 118.36 1.08 . . . . 10.0 113.728 -177.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 77.18 37.92 0.25 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 126.231 1.812 . . . . 10.0 113.583 -177.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 9.8 t -126.03 164.6 20.5 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.427 1.491 . . . . 10.0 111.65 169.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.0 m -102.88 -64.06 1.11 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.686 1.194 . . . . 10.0 111.62 -178.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -122.56 46.51 2.13 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.893 1.277 . . . . 10.0 110.536 -176.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 5.4 m -71.98 116.02 11.88 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 120.824 -1.173 . . . . 10.0 110.068 172.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 t -85.08 138.85 32.16 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.284 0.634 . . . . 10.0 109.612 172.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -36.73 -40.09 0.25 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.49 1.916 . . . . 10.0 112.46 174.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -42.17 -55.17 3.37 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.912 1.285 . . . . 10.0 114.049 170.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -89.45 -33.85 16.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.065 0.546 . . . . 10.0 111.278 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.67 -43.79 65.77 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.417 1.087 . . . . 10.0 111.417 176.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -72.45 -45.15 60.88 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.86 1.264 . . . . 10.0 110.159 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -57.68 -33.5 68.41 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.432 -0.793 . . . . 10.0 111.577 174.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.56 -46.66 84.88 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 124.039 0.935 . . . . 10.0 110.561 -176.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 25.0 pt -76.59 -37.99 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 124.061 0.945 . . . . 10.0 112.28 174.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -58.19 -36.74 73.52 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.893 -0.504 . . . . 10.0 112.345 173.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -51.08 -44.96 61.3 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 174.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -67.62 -75.01 0.1 Allowed 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.618 0.599 . . . . 10.0 112.618 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -153.75 25.51 0.5 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.11 0.564 . . . . 10.0 111.769 -179.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 34.39 61.35 0.55 Allowed 'General case' 0 C--N 1.339 0.143 0 C-N-CA 126.895 2.078 . . . . 10.0 115.696 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -142.84 -56.76 0.43 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.311 -0.858 . . . . 10.0 112.676 -176.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.484 ' HE3' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.954 0 CA-C-O 116.624 -1.655 . . . . 10.0 112.823 -177.83 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 CA--C 1.533 0.312 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -141.17 131.2 24.61 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.159 -1.052 . . . . 10.0 108.159 166.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -46.29 -40.52 11.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.877 1.271 . . . . 10.0 112.783 169.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -56.24 -50.53 71.05 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.684 0.394 . . . . 10.0 111.008 171.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.15 -32.25 72.4 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.906 -0.496 . . . . 10.0 110.788 -176.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mt -64.69 -52.66 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 108.566 -0.901 . . . . 10.0 108.566 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.431 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.07 -41.58 77.35 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 117.882 -1.527 . . . . 10.0 112.033 -178.419 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -68.91 -22.13 64.18 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.757 1.623 . . . . 10.0 112.608 -176.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.0 tttp -95.77 -28.13 14.91 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.976 0.91 . . . . 10.0 113.35 170.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.5 -65.03 1.18 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.287 1.035 . . . . 10.0 112.318 -171.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.431 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.82 41.43 0.21 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.16 1.384 . . . . 10.0 111.013 178.118 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -125.41 -2.38 7.46 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 114.173 1.175 . . . . 10.0 114.173 -164.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 46.9 t -99.46 -47.99 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 124.574 1.15 . . . . 10.0 108.48 -177.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 89.9 m -95.48 -59.43 1.88 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.696 1.998 . . . . 10.0 110.602 -173.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 -74.44 -17.98 60.7 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 -171.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.2 t -62.84 -49.91 73.01 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 122.99 0.516 . . . . 10.0 110.465 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.3 tpt -102.84 -33.78 9.23 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.633 0.773 . . . . 10.0 112.705 176.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 101.45 56.52 0.86 Allowed Glycine 0 CA--C 1.536 1.382 0 C-N-CA 125.078 1.323 . . . . 10.0 111.572 -170.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 82.4 t -98.97 157.74 3.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.631 1.572 . . . . 10.0 109.703 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.15 24.24 11.09 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.448 1.099 . . . . 10.0 112.894 -175.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.18 5.47 87.3 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.124 0.868 . . . . 10.0 113.497 -174.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.87 145.83 77.86 Favored Pre-proline 0 CA--C 1.538 0.484 0 CA-C-N 118.771 1.286 . . . . 10.0 112.545 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -66.11 163.18 32.49 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 C-N-CA 123.599 2.866 . . . . 10.0 109.192 171.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.0 tttp -84.31 149.24 26.2 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 121.624 0.726 . . . . 10.0 110.908 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.7 p -43.28 -70.02 0.12 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.173 1.789 . . . . 10.0 111.4 170.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -103.48 119.98 39.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.823 1.649 . . . . 10.0 108.133 174.085 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -151.76 167.74 27.28 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 126.24 1.816 . . . . 10.0 108.19 171.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.0 m -110.77 -36.21 5.77 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 170.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.36 -14.03 41.85 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.288 -0.883 . . . . 10.0 113.159 -177.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -87.25 -27.21 23.07 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.515 1.926 . . . . 10.0 110.191 176.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 83.9 m95 -95.66 -38.84 10.19 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.367 1.867 . . . . 10.0 112.017 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -41.7 -57.86 3.62 Favored Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 114.682 1.364 . . . . 10.0 114.682 173.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.12 1.16 4.24 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.331 2.687 . . . . 10.0 113.949 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -102.93 -43.66 5.46 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.12 1.368 . . . . 10.0 109.237 177.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.5 5.31 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.107 1.763 . . . . 10.0 114.757 165.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.14 -30.69 18.42 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.59 1.156 . . . . 10.0 110.32 176.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -91.34 -54.66 3.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.121 0.568 . . . . 10.0 111.218 174.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.432 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 161.34 -123.14 1.18 Allowed Glycine 0 CA--C 1.533 1.186 0 N-CA-C 111.782 -0.527 . . . . 10.0 111.782 178.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.45 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -138.4 -65.54 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.271 1.029 . . . . 10.0 111.75 -177.447 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.7 15.86 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.871 1.668 . . . . 10.0 115.304 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.45 ' H ' ' C ' ' A' ' 39' ' ' VAL . 0.3 OUTLIER -93.03 -48.74 6.36 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.401 1.48 . . . . 10.0 108.661 178.152 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.6 mt -81.03 -33.43 33.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 124.325 1.05 . . . . 10.0 110.13 -168.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.4 p -54.59 -32.43 25.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-O 121.651 0.738 . . . . 10.0 111.627 169.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -64.85 -41.71 95.49 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.645 -0.659 . . . . 10.0 110.892 177.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.0 m -67.69 -34.31 76.65 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.52 -0.738 . . . . 10.0 110.338 174.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.0 t -58.38 -52.51 58.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 O-C-N 121.791 -0.568 . . . . 10.0 111.173 175.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.6 -37.45 70.68 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.187 0.44 . . . . 10.0 112.187 174.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -71.87 -33.66 68.57 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.218 0.607 . . . . 10.0 111.972 -177.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.9 97.54 0.25 Allowed Glycine 0 CA--C 1.535 1.285 0 N-CA-C 111.482 -0.647 . . . . 10.0 111.482 -169.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.8 tt -61.54 167.3 3.51 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.845 -0.797 . . . . 10.0 111.197 173.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.402 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 5.1 m-80 -45.51 -58.89 3.04 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.553 -1.342 . . . . 10.0 113.545 -172.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -93.98 19.36 9.16 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.312 1.445 . . . . 10.0 112.859 175.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 34.9 ttp -125.23 129.09 24.6 Favored Pre-proline 0 CA--C 1.553 1.084 0 N-CA-C 114.116 1.154 . . . . 10.0 114.116 173.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -63.06 158.29 44.52 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.229 1.953 . . . . 10.0 111.864 176.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -60.3 148.16 91.13 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.792 2.328 . . . . 10.0 111.021 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 53.12 31.57 41.21 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-N 115.916 -0.583 . . . . 10.0 113.598 -174.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 42.42 32.45 1.21 Allowed Glycine 0 CA--C 1.543 1.813 0 C-N-CA 124.554 1.073 . . . . 10.0 114.534 -170.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.3 ttm 81.24 27.09 0.2 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.068 2.147 . . . . 10.0 114.896 -176.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.7 t -104.76 165.63 10.94 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 120.857 -1.152 . . . . 10.0 112.172 171.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 29.4 m -100.71 -91.94 0.3 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.788 1.235 . . . . 10.0 109.682 174.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -92.57 46.53 1.25 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.441 1.096 . . . . 10.0 110.7 -173.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.61 115.89 16.78 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.692 -1.255 . . . . 10.0 109.943 175.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 93.7 m -80.16 149.82 30.39 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.514 0.725 . . . . 10.0 109.596 174.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -32.77 -55.74 0.37 Allowed 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.123 1.157 . . . . 10.0 114.123 167.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -48.22 -55.47 10.4 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.501 0.72 . . . . 10.0 111.675 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -73.57 -35.68 65.49 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.854 -0.529 . . . . 10.0 111.473 -177.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -56.94 -50.69 71.83 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.751 0.786 . . . . 10.0 110.987 172.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -64.58 -50.59 66.64 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.434 1.494 . . . . 10.0 109.544 -177.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.64 -39.67 25.02 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.033 0.533 . . . . 10.0 112.022 169.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.09 -47.71 60.75 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 120.862 -1.149 . . . . 10.0 112.186 177.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mt -55.94 -48.99 77.8 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 C-N-CA 124.85 1.26 . . . . 10.0 111.431 174.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -24.97 58.29 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.94 -1.1 . . . . 10.0 113.195 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -47.03 -50.63 19.12 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 119.152 0.887 . . . . 10.0 111.295 170.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -70.61 -44.33 67.48 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 178.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -154.2 -77.32 0.11 Allowed 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.928 -0.558 . . . . 10.0 112.35 172.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 157.99 58.22 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 128.697 2.799 . . . . 10.0 111.215 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -174.14 -75.96 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.809 1.411 . . . . 10.0 114.809 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.9 pttp . . . . . 0 C--O 1.256 1.415 0 N-CA-C 115.603 1.705 . . . . 10.0 115.603 -174.412 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.294 0 N-CA-C 112.93 0.715 . . . . 10.0 112.93 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -142.05 124.29 15.54 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 107.302 -1.37 . . . . 10.0 107.302 171.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.98 -37.26 43.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 172.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -55.75 -49.57 72.74 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.648 0.658 . . . . 10.0 109.864 172.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.64 -33.71 74.48 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.866 0.466 . . . . 10.0 111.106 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.91 -51.31 62.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 107.929 -1.137 . . . . 10.0 107.929 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.93 -42.1 77.22 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 119.615 1.098 . . . . 10.0 111.187 -178.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -68.26 -22.23 64.77 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.906 1.282 . . . . 10.0 112.639 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.9 tppt? -93.68 -28.17 16.13 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.485 1.114 . . . . 10.0 113.647 169.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -108.71 -68.87 0.89 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.387 1.475 . . . . 10.0 112.777 -171.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.54 45.05 0.38 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.393 1.477 . . . . 10.0 109.683 179.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.9 t -128.7 -5.5 5.18 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 125.388 1.475 . . . . 10.0 113.343 -167.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.1 t -101.91 -34.19 3.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 125.269 1.427 . . . . 10.0 109.171 -173.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.2 m -102.57 -63.31 1.17 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.101 2.16 . . . . 10.0 110.947 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -73.41 -24.9 60.33 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 114.062 1.134 . . . . 10.0 114.062 -162.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -58.59 -50.79 72.52 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.281 1.032 . . . . 10.0 111.339 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.6 tpt -105.07 -17.9 14.34 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.661 0.784 . . . . 10.0 112.073 -178.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.01 50.17 4.0 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 124.191 0.901 . . . . 10.0 112.17 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 47.0 t -95.51 162.17 2.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 125.344 1.458 . . . . 10.0 109.616 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.84 19.29 8.18 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.632 1.173 . . . . 10.0 113.042 -174.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.9 18.17 79.08 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 124.042 0.829 . . . . 10.0 113.003 -173.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.76 148.57 92.54 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 118.52 1.16 . . . . 10.0 112.649 -178.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -76.14 153.3 36.37 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 124.958 3.772 . . . . 10.0 110.272 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -67.69 144.48 55.45 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.83 -172.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.3 m -34.26 -43.11 0.15 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.898 1.679 . . . . 10.0 113.679 169.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -143.61 110.31 5.56 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.661 0.743 . . . . 10.0 109.765 173.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -129.05 162.93 26.53 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 106.44 -1.689 . . . . 10.0 106.44 174.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 90.2 m -106.17 -36.2 6.97 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.756 0.707 . . . . 10.0 111.157 169.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.06 -26.57 59.49 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 120.63 -1.294 . . . . 10.0 112.735 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -90.07 -8.46 51.39 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.864 1.666 . . . . 10.0 110.645 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.402 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 48.5 m95 -110.73 -29.91 7.8 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.699 -1.25 . . . . 10.0 109.884 176.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -39.49 -60.58 1.24 Allowed Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 125.496 1.518 . . . . 10.0 114.292 170.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -67.99 2.4 2.65 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.295 1.997 . . . . 10.0 113.898 -177.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -113.51 -47.33 3.0 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.246 1.419 . . . . 10.0 110.48 176.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.34 -18.7 63.92 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.731 1.613 . . . . 10.0 112.911 173.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.12 -31.38 61.1 Favored 'General case' 0 N--CA 1.457 -0.104 0 C-N-CA 124.648 1.179 . . . . 10.0 109.588 178.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.1 mmtt -77.79 -56.14 4.75 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.313 171.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.09 -114.25 0.65 Allowed Glycine 0 CA--C 1.531 1.039 0 N-CA-C 111.987 -0.445 . . . . 10.0 111.987 173.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.86 168.16 19.64 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.076 0 C-N-CA 125.567 1.547 . . . . 10.0 109.796 175.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 76.18 -34.04 0.23 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.331 1.452 . . . . 10.0 112.212 -174.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.3 -24.4 54.75 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 120.241 -1.537 . . . . 10.0 114.124 -177.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -105.92 -33.9 7.79 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.461 1.104 . . . . 10.0 111.939 -178.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -56.53 -35.11 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 121.299 -0.876 . . . . 10.0 109.751 170.402 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.13 -42.72 91.29 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.972 1.101 . . . . 10.0 113.972 168.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.9 m -65.9 -39.5 90.66 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 120.688 -1.258 . . . . 10.0 110.442 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 15.6 t -56.31 -51.75 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.49 0.716 . . . . 10.0 110.811 176.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -62.95 -33.83 76.2 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.961 0.726 . . . . 10.0 112.961 176.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 85.3 m -72.31 -24.32 61.3 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.211 0.605 . . . . 10.0 112.314 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.28 92.56 0.3 Allowed Glycine 0 CA--C 1.533 1.218 0 CA-C-N 119.298 0.954 . . . . 10.0 112.371 -178.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -179.09 1.02 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.215 1.007 . . . . 10.0 111.951 175.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -55.97 -54.84 39.98 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 123.557 1.646 . . . . 10.0 111.243 -163.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.93 20.77 10.59 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 128.002 2.521 . . . . 10.0 111.927 176.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -130.75 128.39 22.44 Favored Pre-proline 0 CA--C 1.545 0.76 0 N-CA-C 113.341 0.867 . . . . 10.0 113.341 -177.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -70.02 157.76 58.81 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 121.497 1.465 . . . . 10.0 111.13 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -63.83 114.11 2.45 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 123.415 2.743 . . . . 10.0 109.846 -177.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 92.61 11.94 58.76 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-O 119.853 -0.415 . . . . 10.0 114.097 -171.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.39 -44.06 2.39 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-N 118.692 1.246 . . . . 10.0 113.486 173.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.26 -47.31 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.793 1.637 . . . . 10.0 111.893 172.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.68 159.11 26.82 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.211 1.404 . . . . 10.0 111.673 178.296 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 86.2 m -103.6 -64.17 1.12 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.744 1.218 . . . . 10.0 112.041 175.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -80.92 56.62 2.8 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.967 0.907 . . . . 10.0 110.784 -173.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.12 139.72 36.41 Favored 'General case' 0 CA--C 1.527 0.063 0 C-N-CA 124.642 1.177 . . . . 10.0 110.802 -173.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.0 m -110.77 143.93 40.53 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.12 0.968 . . . . 10.0 108.971 -176.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -47.09 -36.89 8.79 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 114.056 1.132 . . . . 10.0 114.056 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -51.33 -52.62 43.82 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.229 0.922 . . . . 10.0 111.78 170.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.76 -46.32 54.02 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.957 0.799 . . . . 10.0 110.635 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -58.99 -51.66 69.11 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 120.838 -1.164 . . . . 10.0 111.424 -179.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -68.01 -45.03 75.17 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 117.673 -1.156 . . . . 10.0 109.271 -177.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.66 -31.3 36.34 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.796 1.18 . . . . 10.0 112.887 169.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.74 -36.55 31.89 Favored 'General case' 0 C--O 1.222 -0.342 0 O-C-N 120.694 -1.254 . . . . 10.0 112.1 -177.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.0 mt -74.24 -48.27 37.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 125.154 1.381 . . . . 10.0 111.281 174.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -27.75 67.2 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.414 1.086 . . . . 10.0 113.312 175.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 32.4 t80 -46.23 -38.72 8.81 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.666 0.617 . . . . 10.0 112.666 171.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.402 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -87.36 -71.29 0.57 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 122.946 0.498 . . . . 10.0 112.018 -177.356 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.3 t -160.13 36.49 0.17 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.495 0.718 . . . . 10.0 112.312 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.5 ptmm? 33.23 66.55 0.21 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 126.349 1.859 . . . . 10.0 114.796 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -163.17 -49.18 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.141 -0.936 . . . . 10.0 113.356 -178.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.408 ' OXT' ' NZ ' ' A' ' 78' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.72 0 CA-C-O 118.089 -0.958 . . . . 10.0 111.511 179.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.539 0.526 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -151.87 121.07 6.73 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.191 0.996 . . . . 10.0 109.782 -174.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -42.83 -44.39 4.45 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.132 1.373 . . . . 10.0 113.693 170.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -55.96 -50.99 69.25 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.94 0.4 . . . . 10.0 110.312 175.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.33 -31.83 70.54 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.775 -0.578 . . . . 10.0 111.27 -176.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mt -67.59 -51.94 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.24 -41.68 76.64 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 119.077 -1.049 . . . . 10.0 111.025 178.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -67.15 -21.42 65.82 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.315 1.446 . . . . 10.0 112.161 -177.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.41 -27.53 18.26 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.445 1.276 . . . . 10.0 114.445 166.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.69 -70.7 0.8 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.796 1.238 . . . . 10.0 111.582 -168.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.98 38.69 0.17 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.115 1.766 . . . . 10.0 110.224 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.9 t -119.26 -6.13 10.38 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 125.301 1.44 . . . . 10.0 113.833 -167.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.7 t -93.86 -38.06 9.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-O 122.322 1.058 . . . . 10.0 108.304 -175.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.6 m -110.83 -60.18 1.86 Allowed 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 126.474 1.909 . . . . 10.0 109.507 -167.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -74.49 -26.12 59.81 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 114.061 1.134 . . . . 10.0 114.061 -170.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 t -58.55 -55.0 40.72 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.966 0.906 . . . . 10.0 110.916 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.8 mmt -101.07 -23.87 14.41 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.645 1.178 . . . . 10.0 112.06 -178.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.64 52.93 2.7 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 124.92 1.248 . . . . 10.0 112.08 -174.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.7 t -93.25 156.17 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 125.389 1.475 . . . . 10.0 109.525 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.78 25.05 11.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.263 1.025 . . . . 10.0 113.106 -176.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.06 12.05 83.62 Favored Glycine 0 CA--C 1.535 1.306 0 C-N-CA 123.83 0.729 . . . . 10.0 113.206 -175.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.14 152.31 72.2 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 118.289 1.044 . . . . 10.0 111.995 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.26 169.51 21.85 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.739 2.959 . . . . 10.0 110.538 -177.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -78.07 146.68 35.11 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.634 -0.666 . . . . 10.0 112.382 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.17 -30.32 6.66 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.093 1.357 . . . . 10.0 113.976 168.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.6 p80 -146.44 114.92 6.75 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.045 -1.034 . . . . 10.0 110.006 174.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.424 HD21 ' CG ' ' A' ' 30' ' ' ASP . 5.3 m-20 -144.54 168.47 20.08 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.782 -1.192 . . . . 10.0 107.782 174.297 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 97.5 m -109.61 -32.38 7.13 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 119.294 -0.384 . . . . 10.0 110.955 167.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.57 -28.4 45.88 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 114.6 1.333 . . . . 10.0 114.6 -175.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.446 ' CB ' ' HZ3' ' A' ' 78' ' ' LYS . 0.7 OUTLIER -81.15 -33.45 33.14 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.908 0.861 . . . . 10.0 109.498 176.061 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.445 ' CE3' ' HB2' ' A' ' 75' ' ' SER . 62.7 m95 -77.7 -41.08 39.21 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.155 0.982 . . . . 10.0 109.997 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -39.92 -65.04 0.46 Allowed Pre-proline 0 CA--C 1.549 0.907 0 CA-C-N 120.627 1.558 . . . . 10.0 114.9 174.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -70.9 -0.65 8.19 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 123.512 2.808 . . . . 10.0 113.495 -178.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.72 -34.67 9.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.311 1.444 . . . . 10.0 109.905 170.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 tp -98.53 20.68 12.38 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 128.228 2.611 . . . . 10.0 111.998 -173.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -106.89 16.29 24.48 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.638 1.575 . . . . 10.0 110.346 174.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -133.2 -45.3 0.84 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 126.434 1.894 . . . . 10.0 110.504 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 163.46 -142.59 7.96 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 109.343 -1.503 . . . . 10.0 109.343 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.414 ' C ' ' H ' ' A' ' 41' ' ' ASN . 3.1 t -129.75 -55.01 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 123.783 0.833 . . . . 10.0 109.737 -177.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.64 32.93 0.08 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.216 1.806 . . . . 10.0 113.294 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.414 ' H ' ' C ' ' A' ' 39' ' ' VAL . 8.2 m-20 -106.06 -46.56 4.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 128.151 2.58 . . . . 10.0 108.044 176.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -83.17 -40.22 19.99 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.016 0.927 . . . . 10.0 111.51 -173.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 p -55.9 -26.6 21.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-O 121.612 0.72 . . . . 10.0 110.523 171.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.3 mmtt -72.6 -37.35 68.15 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.333 -0.854 . . . . 10.0 112.561 173.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.7 m -67.25 -32.98 74.37 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.973 0.892 . . . . 10.0 110.573 174.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.5 t -57.84 -49.33 81.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 O-C-N 121.443 -0.785 . . . . 10.0 111.858 171.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -28.45 69.66 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.062 0.764 . . . . 10.0 113.062 -177.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.0 p -83.59 -29.62 27.62 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.941 0.719 . . . . 10.0 112.941 174.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.0 101.22 0.33 Allowed Glycine 0 CA--C 1.527 0.818 0 CA-C-N 118.663 0.665 . . . . 10.0 112.445 -171.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.27 173.94 1.36 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.437 0.637 . . . . 10.0 111.141 165.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.413 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 10.3 m-80 -47.69 -57.88 4.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.439 1.496 . . . . 10.0 114.136 -167.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -99.26 23.48 9.15 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.359 1.464 . . . . 10.0 111.264 177.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -112.55 154.99 44.48 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 114.735 1.383 . . . . 10.0 114.735 172.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -76.06 134.44 16.1 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 122.782 2.321 . . . . 10.0 110.539 175.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -66.56 117.27 4.6 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.124 2.549 . . . . 10.0 110.288 178.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.76 30.91 10.7 Favored Glycine 0 C--N 1.343 0.926 0 C-N-CA 120.102 -1.047 . . . . 10.0 110.546 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.18 38.5 6.41 Favored Glycine 0 CA--C 1.531 1.054 0 CA-C-N 117.728 0.764 . . . . 10.0 114.482 178.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 73.48 -59.51 0.56 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.163 1.385 . . . . 10.0 111.367 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.4 t -82.76 98.31 9.03 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 125.151 1.38 . . . . 10.0 110.798 170.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.1 t -59.91 -42.11 93.16 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.422 169.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -79.41 57.22 2.32 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.036 1.334 . . . . 10.0 111.189 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.9 m -127.97 134.43 49.28 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 126.105 1.762 . . . . 10.0 110.975 -175.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 m -103.75 141.7 35.64 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.772 0.829 . . . . 10.0 109.942 -178.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -44.32 -34.95 2.13 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.028 1.121 . . . . 10.0 114.028 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -45.42 -56.65 4.78 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.502 1.121 . . . . 10.0 110.807 169.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.89 -44.59 26.64 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.434 1.494 . . . . 10.0 108.8 -175.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -47.43 85.65 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.012 1.325 . . . . 10.0 110.542 -174.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.0 mtpm? -69.48 -44.46 71.11 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.526 -0.733 . . . . 10.0 111.144 174.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.59 -27.41 6.75 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 119.288 0.949 . . . . 10.0 112.905 170.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.11 -46.48 11.9 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.139 -0.976 . . . . 10.0 110.656 173.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.2 tp -53.42 -34.94 23.86 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.695 1.198 . . . . 10.0 113.214 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.44 -17.95 29.34 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.288 1.435 . . . . 10.0 113.214 177.37 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -53.05 -44.99 67.85 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.402 -0.811 . . . . 10.0 111.941 174.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.3 mpp? -71.62 -62.19 1.5 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.479 1.112 . . . . 10.0 112.362 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.445 ' HB2' ' CE3' ' A' ' 31' ' ' TRP . 15.4 m -141.66 -93.84 0.14 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.215 1.006 . . . . 10.0 110.056 172.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.8 ptmt -174.89 56.11 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.984 1.313 . . . . 10.0 109.022 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.71 -75.38 0.05 Allowed 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 114.26 1.207 . . . . 10.0 114.26 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.446 ' HZ3' ' CB ' ' A' ' 30' ' ' ASP . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.186 0 N-CA-C 115.761 1.763 . . . . 10.0 115.761 -160.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 112.47 0.544 . . . . 10.0 112.47 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -147.22 122.75 10.42 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.433 0.635 . . . . 10.0 109.459 -176.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -45.25 -40.77 7.81 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.794 1.238 . . . . 10.0 113.522 167.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -54.87 -50.82 67.76 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-N 118.117 0.417 . . . . 10.0 110.617 172.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.38 -31.52 70.95 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 122.022 -0.424 . . . . 10.0 110.647 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.75 -51.99 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 108.633 -0.877 . . . . 10.0 108.633 177.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.74 -41.95 74.59 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 118.951 -1.1 . . . . 10.0 111.251 -177.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -68.17 -22.05 64.86 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.809 1.644 . . . . 10.0 112.16 -177.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.42 -29.07 16.47 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.932 1.086 . . . . 10.0 113.932 166.535 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -106.05 -67.27 0.94 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.263 1.025 . . . . 10.0 112.933 -170.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.73 43.05 0.39 Allowed 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.883 1.273 . . . . 10.0 109.374 -179.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 t -126.79 -5.0 6.37 Favored 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 125.333 1.453 . . . . 10.0 113.501 -165.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 41.2 t -99.02 -51.63 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 124.985 1.314 . . . . 10.0 108.083 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 80.4 m -92.01 -59.01 2.21 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.426 1.891 . . . . 10.0 109.906 -174.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 -73.97 -16.92 61.06 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.033 1.123 . . . . 10.0 114.033 -171.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.7 t -65.34 -50.01 67.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.766 -0.584 . . . . 10.0 111.24 -178.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 tpt -106.96 -26.27 11.26 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.291 1.036 . . . . 10.0 112.256 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.78 55.22 1.33 Allowed Glycine 0 CA--C 1.535 1.343 0 C-N-CA 125.211 1.386 . . . . 10.0 111.9 -174.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 90.8 t -95.6 156.46 3.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 125.291 1.437 . . . . 10.0 109.69 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.12 25.95 11.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.218 1.007 . . . . 10.0 112.802 -174.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.74 7.44 88.21 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.105 0.86 . . . . 10.0 113.508 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.43 147.03 92.73 Favored Pre-proline 0 CA--C 1.55 0.977 0 CA-C-N 118.807 1.304 . . . . 10.0 112.35 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -67.12 172.23 10.22 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 125.099 3.866 . . . . 10.0 110.29 172.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -124.26 135.33 53.33 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.763 0.825 . . . . 10.0 111.52 -176.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 p -78.79 52.89 1.28 Allowed 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.825 -1.172 . . . . 10.0 113.166 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -146.54 -43.3 0.19 Allowed 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.885 1.439 . . . . 10.0 114.885 178.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.67 146.13 32.62 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.932 1.293 . . . . 10.0 108.877 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 38.2 m -94.44 -29.0 15.19 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.253 0.933 . . . . 10.0 110.155 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.46 -29.85 68.1 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.689 0.996 . . . . 10.0 113.689 177.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.458 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 60.7 t0 -71.32 -34.03 70.2 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.434 1.094 . . . . 10.0 109.26 174.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.434 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 49.0 m95 -90.03 -31.27 17.26 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 125.094 1.358 . . . . 10.0 113.254 -175.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -47.01 -56.59 11.48 Favored Pre-proline 0 CA--C 1.541 0.613 0 O-C-N 120.493 -1.379 . . . . 10.0 114.603 174.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.43 -0.02 4.59 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 122.579 2.186 . . . . 10.0 113.278 -178.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.401 ' C ' ' H ' ' A' ' 36' ' ' ALA . 19.8 mmm180 -93.6 -49.19 6.0 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.499 -0.751 . . . . 10.0 109.567 170.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.36 22.8 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.533 1.308 . . . . 10.0 114.533 170.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.401 ' H ' ' C ' ' A' ' 34' ' ' ARG . . . -93.94 -37.76 11.53 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.396 1.078 . . . . 10.0 109.698 176.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt -85.83 -46.01 11.04 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.948 0.899 . . . . 10.0 111.151 175.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 152.81 -143.58 10.46 Favored Glycine 0 CA--C 1.534 1.248 0 N-CA-C 110.353 -1.099 . . . . 10.0 110.353 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.8 t -123.76 -54.53 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.194 0.998 . . . . 10.0 110.901 -174.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.95 -13.85 7.6 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.443 1.497 . . . . 10.0 113.207 -178.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -72.84 -16.04 61.61 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 126.093 1.757 . . . . 10.0 113.47 175.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 mp -103.9 -43.99 5.16 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.228 0.611 . . . . 10.0 110.379 -171.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.3 p -53.8 -34.15 24.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.05 0.54 . . . . 10.0 111.103 170.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.6 ptmt -63.51 -43.96 95.68 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.823 -1.173 . . . . 10.0 113.91 170.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.5 m -66.55 -32.72 74.24 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 120.631 -1.293 . . . . 10.0 110.034 -178.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 40.5 t -60.43 -54.89 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 123.563 0.745 . . . . 10.0 111.099 172.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.62 -31.9 69.92 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.903 0.705 . . . . 10.0 112.903 178.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.8 m -71.1 -27.48 63.62 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.442 0.697 . . . . 10.0 112.471 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 74.31 90.68 0.17 Allowed Glycine 0 CA--C 1.529 0.969 0 CA-C-N 119.196 0.907 . . . . 10.0 112.539 -175.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.41 168.51 2.71 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.961 0.886 . . . . 10.0 111.634 173.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.43 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 8.5 m-80 -52.98 -57.96 8.58 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 120.468 -1.395 . . . . 10.0 112.85 -169.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.6 17.94 3.04 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.189 1.396 . . . . 10.0 112.722 173.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ttp -131.66 130.26 22.31 Favored Pre-proline 0 CA--C 1.545 0.763 0 N-CA-C 115.021 1.489 . . . . 10.0 115.021 -175.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.08 143.04 76.98 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 121.452 1.434 . . . . 10.0 112.309 -178.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -61.92 133.06 42.53 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 123.679 2.919 . . . . 10.0 109.946 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.79 11.75 85.13 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 119.579 -1.296 . . . . 10.0 112.735 -173.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 56.81 53.94 40.32 Favored Glycine 0 CA--C 1.532 1.138 0 O-C-N 120.74 -1.447 . . . . 10.0 110.88 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 80.12 -45.52 0.29 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.835 2.054 . . . . 10.0 112.603 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.08 162.39 25.89 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.642 0.777 . . . . 10.0 111.583 175.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.7 m -114.42 -57.41 2.28 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.315 1.046 . . . . 10.0 110.504 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -82.48 68.03 8.76 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 122.418 1.104 . . . . 10.0 109.871 -178.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.76 116.79 32.34 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.837 1.655 . . . . 10.0 110.432 -177.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -84.48 130.63 34.74 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 126.557 1.943 . . . . 10.0 109.334 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -45.58 -35.72 4.19 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.898 0.879 . . . . 10.0 113.261 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -50.17 -59.76 3.62 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.187 0.995 . . . . 10.0 113.162 167.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -74.62 -26.47 59.92 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 120.961 -1.087 . . . . 10.0 109.907 -177.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -55.82 14.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.909 1.284 . . . . 10.0 110.959 177.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.55 -44.49 96.93 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 177.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.75 -24.96 38.34 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.412 0.523 . . . . 10.0 112.412 173.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -85.61 -48.0 9.3 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.534 -0.729 . . . . 10.0 109.86 176.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.2 tp -57.42 -30.33 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.705 1.602 . . . . 10.0 112.747 178.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.63 -28.56 23.14 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.205 1.002 . . . . 10.0 113.549 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -51.87 -51.35 57.33 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.431 1.014 . . . . 10.0 112.139 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.434 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.3 mpp? -64.96 -36.87 85.78 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.718 0.636 . . . . 10.0 112.718 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -166.8 -74.18 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.465 0.706 . . . . 10.0 110.934 172.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 164.1 43.58 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 128.281 2.632 . . . . 10.0 110.842 -170.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.63 -81.58 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 115.418 1.636 . . . . 10.0 115.418 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.458 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 3.0 ptpt . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.282 -1.342 . . . . 10.0 113.925 -176.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.535 0.372 0 CA-C-O 120.064 -0.017 . . . . 10.0 111.013 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 58.5 t0 -149.52 119.82 7.32 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.198 0.999 . . . . 10.0 110.007 173.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -44.52 -42.34 7.12 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.004 1.321 . . . . 10.0 113.93 167.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -57.94 -46.58 84.83 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 122.208 -0.307 . . . . 10.0 110.428 173.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.41 -34.18 76.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.963 -0.461 . . . . 10.0 110.701 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.5 mm -64.86 -51.25 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 O-C-N 121.575 -0.703 . . . . 10.0 109.143 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.1 -42.01 76.68 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 117.791 -1.563 . . . . 10.0 111.988 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.61 -22.0 64.47 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.513 1.525 . . . . 10.0 112.579 -176.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -92.64 -29.21 16.24 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.548 1.139 . . . . 10.0 113.249 170.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.18 -64.49 1.29 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.143 0.977 . . . . 10.0 112.995 -170.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.04 37.81 0.16 Allowed 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.811 1.244 . . . . 10.0 110.887 178.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -120.57 -1.35 10.1 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 125.024 1.329 . . . . 10.0 113.316 -165.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.2 t -105.66 -46.57 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 124.647 1.179 . . . . 10.0 108.874 -171.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.9 m -87.82 -64.52 1.14 Allowed 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 125.703 1.601 . . . . 10.0 111.571 174.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -72.57 -25.57 61.4 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.565 0.746 . . . . 10.0 112.993 -162.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.8 t -55.01 -50.31 69.36 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.874 1.269 . . . . 10.0 111.094 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.5 tpt -106.08 -21.29 13.17 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.945 0.898 . . . . 10.0 112.635 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.56 45.27 3.76 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.138 0.875 . . . . 10.0 112.353 -176.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 57.7 t -86.06 160.18 3.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 124.568 1.147 . . . . 10.0 109.384 177.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.97 17.16 5.15 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.806 1.243 . . . . 10.0 113.531 -175.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.84 18.38 78.91 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.128 0.87 . . . . 10.0 113.417 -173.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.0 143.55 98.02 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-N 118.507 1.154 . . . . 10.0 112.831 -177.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -66.96 147.47 80.31 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.142 3.228 . . . . 10.0 110.118 177.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -69.1 139.49 54.77 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.792 -167.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 72.4 m -37.96 -35.3 0.15 Allowed 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.48 1.512 . . . . 10.0 114.512 173.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -141.94 108.75 5.4 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.737 1.615 . . . . 10.0 107.862 174.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -135.28 167.28 21.31 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.757 1.623 . . . . 10.0 106.737 171.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 88.2 m -110.84 -35.77 5.87 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.385 0.539 . . . . 10.0 112.123 171.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.05 -17.19 44.13 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 121.119 -0.988 . . . . 10.0 113.072 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -85.23 -29.77 24.39 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.272 1.829 . . . . 10.0 110.114 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.44 ' CH2' ' HE2' ' A' ' 78' ' ' LYS . 50.4 m95 -92.61 -38.34 11.94 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.869 2.068 . . . . 10.0 111.204 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -41.78 -60.52 1.89 Allowed Pre-proline 0 CA--C 1.552 1.038 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 173.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -64.24 -4.79 8.43 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.561 2.841 . . . . 10.0 114.053 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -98.25 -53.02 3.48 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.748 1.619 . . . . 10.0 108.308 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.4 mt -58.9 -19.39 41.79 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.566 1.547 . . . . 10.0 113.338 174.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.16 -30.58 55.07 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.143 1.377 . . . . 10.0 109.488 -177.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -82.57 -52.2 7.05 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.854 -0.424 . . . . 10.0 109.854 174.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.487 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 167.99 -125.26 1.28 Allowed Glycine 0 CA--C 1.532 1.106 0 N-CA-C 111.339 -0.704 . . . . 10.0 111.339 177.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.408 ' C ' ' H ' ' A' ' 41' ' ' ASN . 2.7 t -141.61 -59.71 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-O 122.105 0.955 . . . . 10.0 109.461 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -71.69 17.35 0.09 Allowed 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 124.277 1.031 . . . . 10.0 112.652 -173.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.487 HD22 ' N ' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -98.43 -18.36 18.29 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 128.249 2.62 . . . . 10.0 110.39 177.366 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -101.51 -41.92 6.44 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.999 0.92 . . . . 10.0 111.053 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.3 p -49.62 -35.38 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-O 121.477 0.656 . . . . 10.0 111.264 170.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 ptmt -63.66 -44.39 93.91 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 114.707 1.373 . . . . 10.0 114.707 172.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.14 -23.61 63.03 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 119.156 0.889 . . . . 10.0 110.91 178.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.0 t -67.33 -53.92 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 O-C-N 121.584 -0.697 . . . . 10.0 111.703 168.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.51 -34.82 74.65 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.949 -0.469 . . . . 10.0 112.035 177.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.64 -31.32 61.92 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.39 0.676 . . . . 10.0 112.169 177.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.0 105.5 0.15 Allowed Glycine 0 C--N 1.341 0.808 0 N-CA-C 111.485 -0.646 . . . . 10.0 111.485 -166.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.5 tp -63.14 172.01 2.04 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.877 -0.778 . . . . 10.0 110.247 167.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.408 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 7.8 m-80 -49.02 -58.27 5.18 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.742 1.217 . . . . 10.0 113.488 -169.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -86.09 18.97 2.81 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.018 1.327 . . . . 10.0 112.923 174.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 5.9 mtp -119.24 147.28 42.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 N-CA-C 114.269 1.211 . . . . 10.0 114.269 173.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.29 141.44 32.13 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.137 1.891 . . . . 10.0 110.425 172.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -61.6 124.36 14.48 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.003 2.469 . . . . 10.0 109.884 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.67 17.03 57.52 Favored Glycine 0 C--N 1.34 0.776 0 C-N-CA 119.994 -1.098 . . . . 10.0 111.824 -178.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 52.93 36.3 50.51 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 118.875 1.337 . . . . 10.0 113.511 172.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 66.54 21.99 10.65 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.323 1.849 . . . . 10.0 114.102 -175.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.9 t -122.74 166.61 14.65 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.287 1.835 . . . . 10.0 110.577 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.8 t -115.47 -55.59 2.43 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.393 1.077 . . . . 10.0 111.551 177.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -115.43 49.97 1.04 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.714 1.206 . . . . 10.0 110.99 -177.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.9 m -80.09 117.54 20.99 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 120.394 -1.441 . . . . 10.0 110.624 174.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 34.7 p -79.7 139.0 37.51 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -45.51 -32.22 2.14 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.757 0.823 . . . . 10.0 113.202 176.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -52.61 -61.8 2.05 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 119.257 0.935 . . . . 10.0 112.535 169.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -27.77 62.39 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.551 -0.718 . . . . 10.0 110.495 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -50.02 45.45 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.46 1.124 . . . . 10.0 109.972 -177.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -64.85 -51.65 60.88 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 124.58 1.152 . . . . 10.0 109.021 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.43 -35.07 12.07 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 118.871 0.759 . . . . 10.0 112.523 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.27 -34.04 61.31 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 120.946 -1.096 . . . . 10.0 112.213 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.65 -51.57 27.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.048 1.739 . . . . 10.0 110.7 175.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.6 -28.32 69.84 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.033 1.333 . . . . 10.0 112.881 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -42.16 -41.34 2.64 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.884 0.698 . . . . 10.0 112.884 170.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.412 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -77.59 -69.77 0.52 Allowed 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 111.998 0.369 . . . . 10.0 111.998 179.854 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.8 t -163.08 32.23 0.09 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.685 0.995 . . . . 10.0 113.685 -176.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 37.29 53.95 1.3 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.443 1.897 . . . . 10.0 115.047 177.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -140.77 -54.64 0.5 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.923 0.889 . . . . 10.0 112.836 -177.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.44 ' HE2' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.898 0 CA-C-O 116.666 -1.635 . . . . 10.0 110.559 171.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.522 0 N-CA-C 114.281 1.215 . . . . 10.0 114.281 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.417 ' CG ' ' H ' ' A' ' 3' ' ' ALA . 15.0 t70 -136.93 -168.09 2.21 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 106.218 -1.771 . . . . 10.0 106.218 -177.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.417 ' H ' ' CG ' ' A' ' 2' ' ' ASP . . . -103.34 -41.75 5.93 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 127.522 2.329 . . . . 10.0 111.998 176.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -54.85 -51.5 65.7 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 122.195 0.997 . . . . 10.0 109.772 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.96 -30.08 69.28 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.144 -0.935 . . . . 10.0 110.858 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.56 -52.0 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -69.71 -40.08 76.49 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.758 0.708 . . . . 10.0 110.39 -176.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -68.94 -23.95 64.21 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.391 1.077 . . . . 10.0 112.035 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.41 -30.66 19.32 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.612 1.338 . . . . 10.0 114.612 166.335 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.65 -69.54 0.86 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.959 1.304 . . . . 10.0 111.637 -167.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 43.95 0.25 Allowed 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 125.516 1.526 . . . . 10.0 110.345 178.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.9 t -127.1 -7.13 5.98 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.701 1.601 . . . . 10.0 113.668 -167.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 48.4 t -94.17 -42.72 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 N-CA-C 108.243 -1.021 . . . . 10.0 108.243 -175.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.9 m -104.97 -57.2 2.06 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.737 1.615 . . . . 10.0 109.358 -173.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -74.13 -14.77 61.02 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 114.825 1.417 . . . . 10.0 114.825 -171.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.6 t -70.24 -43.99 69.44 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.434 0.693 . . . . 10.0 110.408 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 25.5 mmt -114.64 -40.42 3.58 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.271 1.428 . . . . 10.0 112.247 -175.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.21 61.67 1.13 Allowed Glycine 0 CA--C 1.535 1.322 0 C-N-CA 125.737 1.637 . . . . 10.0 112.682 -178.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 94.0 t -82.65 -56.53 5.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 121.631 0.729 . . . . 10.0 111.991 -175.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.97 30.79 0.44 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.909 0.884 . . . . 10.0 111.211 177.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 65.83 18.41 66.32 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 124.026 0.822 . . . . 10.0 113.195 -172.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.23 142.88 97.79 Favored Pre-proline 0 CA--C 1.539 0.536 0 O-C-N 121.681 -0.894 . . . . 10.0 111.676 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -75.27 149.38 35.55 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 122.841 2.361 . . . . 10.0 111.182 -172.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -63.58 134.5 55.6 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.041 -0.527 . . . . 10.0 112.34 -175.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.1 p -48.08 -22.96 0.7 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.079 1.752 . . . . 10.0 114.453 173.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.76 40.14 1.84 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.135 0.879 . . . . 10.0 113.125 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -77.09 151.36 35.48 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.524 -0.735 . . . . 10.0 110.607 169.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.3 m -107.51 -30.57 8.56 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.704 0.402 . . . . 10.0 110.978 165.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.63 -36.58 70.78 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.945 -1.097 . . . . 10.0 113.179 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -79.23 -30.18 43.09 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.91 0.862 . . . . 10.0 110.281 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.9 m95 -82.48 -31.56 29.28 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.967 1.707 . . . . 10.0 111.751 178.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -40.7 -62.04 1.08 Allowed Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.07 1.348 . . . . 10.0 113.954 172.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.17 6.66 2.08 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.851 2.367 . . . . 10.0 113.787 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 -108.49 -42.63 4.51 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.18 1.392 . . . . 10.0 109.345 177.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.05 6.12 2.32 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.081 1.752 . . . . 10.0 112.823 176.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.19 -34.96 37.01 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.53 1.532 . . . . 10.0 109.205 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -80.92 -61.01 2.09 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.3 170.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 150.17 -127.94 2.54 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.428 -0.669 . . . . 10.0 111.428 175.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.9 m -122.42 172.77 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 126.331 1.852 . . . . 10.0 109.172 175.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 63.15 9.5 3.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.838 1.255 . . . . 10.0 113.832 -176.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -92.63 -62.14 1.45 Allowed 'General case' 0 C--N 1.343 0.295 0 CA-C-O 122.419 1.104 . . . . 10.0 108.913 170.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.66 -26.66 60.01 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.734 0.814 . . . . 10.0 111.468 -172.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.01 -29.43 46.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 O-C-N 121.611 -0.681 . . . . 10.0 110.371 173.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -69.28 -43.0 74.76 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.538 -0.727 . . . . 10.0 110.976 176.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -39.09 93.08 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.507 -0.746 . . . . 10.0 109.939 176.196 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.4 t -56.12 -48.55 78.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.407 0.623 . . . . 10.0 111.85 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.97 -32.01 72.97 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.896 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 54.6 m -74.47 -29.66 61.54 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.083 0.953 . . . . 10.0 113.547 175.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.29 117.98 0.35 Allowed Glycine 0 CA--C 1.529 0.962 0 CA-C-N 119.306 0.957 . . . . 10.0 111.496 -170.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.6 tp -72.56 -145.3 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.162 0.985 . . . . 10.0 110.628 168.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -80.64 -67.24 0.79 Allowed 'General case' 0 N--CA 1.477 0.893 0 O-C-N 119.648 -1.907 . . . . 10.0 111.301 -174.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.2 -14.74 60.14 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.276 1.43 . . . . 10.0 111.381 176.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 ttp -97.67 120.44 60.48 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 123.726 0.81 . . . . 10.0 110.862 -175.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -70.74 157.22 59.11 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 121.718 1.612 . . . . 10.0 111.31 -175.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -62.49 116.88 3.8 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 123.031 2.488 . . . . 10.0 110.23 -179.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 98.49 35.91 4.78 Favored Glycine 0 C--N 1.344 1.018 0 CA-C-N 118.058 0.39 . . . . 10.0 113.104 -176.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 53.39 -86.66 0.01 OUTLIER Glycine 0 CA--C 1.537 1.425 0 C-N-CA 124.533 1.063 . . . . 10.0 113.998 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.6 ttt -171.98 40.16 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 127.242 2.217 . . . . 10.0 110.226 172.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.8 p -131.29 170.76 14.17 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.56 1.319 . . . . 10.0 114.56 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 55.3 m -81.99 -98.77 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.928 1.291 . . . . 10.0 109.966 175.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -82.35 64.29 6.94 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.957 -1.089 . . . . 10.0 109.434 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 4.2 m -60.75 86.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.807 0 CA-C-O 121.301 0.572 . . . . 10.0 111.495 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.3 p -78.23 132.27 37.48 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 120.776 -1.203 . . . . 10.0 108.186 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -46.77 -32.04 3.4 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.966 0.906 . . . . 10.0 112.515 178.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -52.72 -59.48 4.43 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.327 1.451 . . . . 10.0 113.968 166.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -73.89 -36.07 64.75 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 107.932 -1.136 . . . . 10.0 107.932 -175.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -55.92 -60.24 3.75 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 123.165 0.586 . . . . 10.0 111.064 172.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.8 ptmt -57.82 -48.32 80.09 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.338 1.055 . . . . 10.0 109.873 -177.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.94 -22.25 14.42 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.758 0.651 . . . . 10.0 112.758 172.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -101.79 -9.82 20.46 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 124.701 1.2 . . . . 10.0 113.859 -174.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -99.94 -38.76 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.962 0.905 . . . . 10.0 109.809 167.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -37.93 77.36 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.322 0.649 . . . . 10.0 111.698 175.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -49.93 -38.56 36.85 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.015 0.926 . . . . 10.0 112.462 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -79.35 -65.17 1.03 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.625 0.37 . . . . 10.0 111.991 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 t -164.3 27.94 0.07 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 119.451 -0.9 . . . . 10.0 112.917 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt 40.0 46.81 1.84 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.784 0.834 . . . . 10.0 113.134 -175.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.64 -84.66 0.47 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.887 1.275 . . . . 10.0 113.435 173.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.277 0 N-CA-C 115.651 1.722 . . . . 10.0 115.651 -164.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 8.4 mp0 . . . . . 0 CA--C 1.528 0.129 0 N-CA-C 112.144 0.424 . . . . 10.0 112.144 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -141.62 123.38 15.22 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 108.636 -0.876 . . . . 10.0 108.636 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -54.1 -36.1 62.84 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 124.134 0.974 . . . . 10.0 112.679 172.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -59.04 -47.41 85.34 Favored 'General case' 0 C--N 1.34 0.17 0 N-CA-C 110.426 -0.212 . . . . 10.0 110.426 170.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.78 -34.33 76.58 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.743 -0.598 . . . . 10.0 110.621 -178.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 33.8 mt -64.37 -51.61 66.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 N-CA-C 108.428 -0.952 . . . . 10.0 108.428 178.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.447 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -69.29 -42.3 75.66 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 117.695 -1.602 . . . . 10.0 112.294 -179.757 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -68.86 -22.48 64.2 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.641 1.576 . . . . 10.0 112.752 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -94.78 -28.8 15.09 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.95 0.722 . . . . 10.0 112.95 170.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -108.11 -64.94 1.16 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.052 0.941 . . . . 10.0 112.562 -171.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.447 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.42 44.16 0.34 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.742 1.217 . . . . 10.0 110.483 179.278 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.5 t -129.8 -6.32 4.55 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 124.883 1.273 . . . . 10.0 113.794 -164.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.6 t -97.11 -46.74 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 124.779 1.231 . . . . 10.0 108.236 -176.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 82.3 m -92.07 -63.68 1.21 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 127.582 2.353 . . . . 10.0 110.507 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -73.61 -20.92 60.46 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.961 1.097 . . . . 10.0 113.961 -167.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.8 t -57.82 -53.59 56.46 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.505 1.122 . . . . 10.0 111.394 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.0 tpt -108.91 -12.78 14.84 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.768 0.827 . . . . 10.0 112.422 -178.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.42 40.84 7.64 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.266 0.936 . . . . 10.0 112.264 -175.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 68.8 t -80.08 155.91 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.469 1.108 . . . . 10.0 109.149 176.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 55.6 21.63 4.65 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.772 1.229 . . . . 10.0 113.619 -176.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.87 20.52 76.02 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 124.231 0.919 . . . . 10.0 113.842 -176.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.83 141.77 79.22 Favored Pre-proline 0 CA--C 1.547 0.856 0 CA-C-N 118.64 1.22 . . . . 10.0 113.681 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.31 132.7 13.97 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 124.763 3.642 . . . . 10.0 111.815 -176.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -61.49 142.77 56.8 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.705 -1.247 . . . . 10.0 113.835 -161.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.0 m -50.83 -33.59 24.27 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.347 0.869 . . . . 10.0 113.347 176.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -125.63 117.61 23.9 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.248 1.019 . . . . 10.0 108.698 167.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -151.8 163.55 38.94 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.278 1.831 . . . . 10.0 106.838 172.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 96.5 m -110.08 -36.6 5.81 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.45 0.568 . . . . 10.0 111.138 170.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.95 -19.61 34.34 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.501 -0.749 . . . . 10.0 113.02 -175.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -83.09 -34.08 26.22 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.279 1.432 . . . . 10.0 110.283 178.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.421 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 63.7 m95 -82.24 -40.73 21.2 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.233 1.813 . . . . 10.0 111.624 176.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -39.49 -60.11 1.39 Allowed Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 114.496 1.295 . . . . 10.0 114.496 175.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -65.04 -8.3 17.87 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.389 2.726 . . . . 10.0 114.151 -177.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -95.77 -53.48 3.69 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.845 0.858 . . . . 10.0 110.152 170.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.47 -18.88 4.76 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.641 1.577 . . . . 10.0 113.394 178.073 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.63 -32.81 36.14 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.637 1.575 . . . . 10.0 109.993 -176.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.54 -46.65 12.18 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.876 -0.787 . . . . 10.0 108.876 174.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 163.88 -142.82 8.09 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 110.892 -0.883 . . . . 10.0 110.892 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.4 t -134.63 -56.27 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 122.707 1.241 . . . . 10.0 109.673 -174.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.67 -29.86 28.76 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 127.167 2.187 . . . . 10.0 111.232 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -20.12 14.8 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.421 1.888 . . . . 10.0 113.916 175.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -103.13 -43.53 5.45 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.844 0.858 . . . . 10.0 111.061 -175.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 p -53.69 -34.07 23.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 118.119 0.418 . . . . 10.0 111.185 171.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -59.29 -48.55 81.21 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.099 1.148 . . . . 10.0 114.099 167.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.9 m -62.86 -35.14 79.0 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 120.617 -1.302 . . . . 10.0 110.152 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 28.5 t -58.04 -54.18 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.055 173.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.5 ptmt -61.83 -33.74 74.7 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.573 0.582 . . . . 10.0 112.573 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 97.6 m -72.01 -33.54 68.14 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.48 0.712 . . . . 10.0 112.37 -178.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.54 98.34 0.42 Allowed Glycine 0 CA--C 1.531 1.08 0 CA-C-N 118.809 0.731 . . . . 10.0 111.929 -173.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 5.0 tp -67.48 170.13 8.01 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.279 1.031 . . . . 10.0 111.106 174.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -52.68 -57.65 9.38 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.736 -1.228 . . . . 10.0 112.365 -171.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.32 20.9 9.74 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.33 1.452 . . . . 10.0 112.383 172.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 40.3 ttp -125.6 125.34 25.01 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 114.001 1.112 . . . . 10.0 114.001 172.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -61.87 151.22 82.44 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.868 1.712 . . . . 10.0 111.925 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -61.57 140.15 85.36 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 123.171 2.58 . . . . 10.0 110.677 -177.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.75 30.76 73.43 Favored Glycine 0 CA--C 1.53 1.008 0 CA-C-N 116.502 -0.317 . . . . 10.0 112.734 -170.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.51 36.27 5.93 Favored Glycine 0 CA--C 1.536 1.396 0 O-C-N 121.693 -0.886 . . . . 10.0 114.314 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.2 ttt 84.93 12.41 0.26 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.936 2.094 . . . . 10.0 114.685 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.7 m -106.35 167.52 9.78 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.594 1.158 . . . . 10.0 112.338 171.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.1 m -131.19 -49.48 1.01 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.882 1.673 . . . . 10.0 110.167 171.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -79.43 -29.77 42.02 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.414 1.486 . . . . 10.0 112.693 -175.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 21.9 m -55.21 122.29 10.73 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.108 1.763 . . . . 10.0 111.197 179.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.0 m -103.0 162.22 13.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.55 1.94 . . . . 10.0 109.539 -176.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -44.98 -44.77 10.14 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.788 -1.195 . . . . 10.0 113.627 176.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -50.0 -40.11 43.34 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.838 0.855 . . . . 10.0 112.248 174.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.46 -44.08 14.0 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.619 0.767 . . . . 10.0 111.154 178.239 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -58.03 -50.2 74.23 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.895 -1.128 . . . . 10.0 112.285 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -58.41 -46.52 86.29 Favored 'General case' 0 N--CA 1.463 0.216 0 O-C-N 121.783 -0.573 . . . . 10.0 110.027 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.5 -34.34 64.52 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 121.923 0.868 . . . . 10.0 112.858 170.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.34 -41.28 63.65 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 120.222 -1.549 . . . . 10.0 111.456 -178.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.2 pt -75.69 -33.13 25.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 O-C-N 121.646 -0.659 . . . . 10.0 112.634 175.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -69.86 -32.69 71.2 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.566 -0.709 . . . . 10.0 111.206 174.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -48.51 -48.34 38.22 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 119.092 0.86 . . . . 10.0 111.167 172.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 73.3 mtm -71.76 -51.82 20.76 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.748 -0.66 . . . . 10.0 112.152 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -154.15 -79.29 0.1 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 117.595 0.18 . . . . 10.0 111.317 173.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 161.48 47.05 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.595 2.758 . . . . 10.0 110.68 -176.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.2 -88.58 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.478 0.918 . . . . 10.0 113.478 175.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.421 ' HE2' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.136 0 N-CA-C 115.205 1.557 . . . . 10.0 115.205 -172.061 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 114.036 1.125 . . . . 10.0 114.036 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -143.5 -164.2 1.81 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.775 2.03 . . . . 10.0 107.193 -174.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.75 -44.26 4.07 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 127.29 2.236 . . . . 10.0 111.664 172.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -58.84 -48.35 81.65 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.941 -0.474 . . . . 10.0 111.649 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.44 -28.61 68.74 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.336 -0.852 . . . . 10.0 110.96 -177.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.4 mp -69.24 -51.65 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.128 -1.064 . . . . 10.0 108.128 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.34 -41.95 79.99 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 118.026 -1.47 . . . . 10.0 111.747 177.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -67.97 -22.11 65.04 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.956 1.702 . . . . 10.0 112.778 -176.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.58 -28.42 16.04 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.838 1.051 . . . . 10.0 113.838 167.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -105.73 -67.77 0.91 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.131 0.972 . . . . 10.0 112.057 -171.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.04 41.86 0.3 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 125.251 1.42 . . . . 10.0 110.365 -179.029 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -128.46 -7.11 5.23 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 125.657 1.583 . . . . 10.0 113.283 -167.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.2 t -94.52 -39.97 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.134 0.973 . . . . 10.0 108.54 -176.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.7 m -106.93 -55.71 2.29 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.779 1.632 . . . . 10.0 110.629 -172.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 -75.19 -19.67 59.69 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.665 1.357 . . . . 10.0 114.665 -172.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m -65.45 -51.64 58.76 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.464 0.705 . . . . 10.0 110.237 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.71 -34.59 10.47 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.092 1.357 . . . . 10.0 111.595 -177.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.09 57.74 1.0 Allowed Glycine 0 CA--C 1.537 1.451 0 C-N-CA 126.296 1.903 . . . . 10.0 112.508 -174.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 18.5 t -94.9 153.68 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 124.769 1.227 . . . . 10.0 110.435 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.09 20.84 5.85 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.241 1.416 . . . . 10.0 113.528 -177.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.9 22.31 69.27 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.561 1.077 . . . . 10.0 113.571 -173.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.69 143.14 94.69 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 118.516 1.158 . . . . 10.0 112.606 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -74.22 146.99 36.93 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 124.776 3.651 . . . . 10.0 110.571 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -74.54 135.45 42.15 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.812 -0.555 . . . . 10.0 111.657 -167.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.66 -34.12 4.81 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.651 1.18 . . . . 10.0 113.472 178.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 48.8 p-80 -125.32 103.57 8.0 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.803 1.641 . . . . 10.0 108.971 170.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -141.24 161.8 37.02 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 107.182 -1.414 . . . . 10.0 107.182 170.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 59.7 m -109.94 -35.6 6.1 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.408 0.549 . . . . 10.0 111.35 171.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.48 -12.65 45.38 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.295 -0.878 . . . . 10.0 113.293 -177.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.442 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 13.7 t0 -88.58 -25.77 22.31 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.641 1.576 . . . . 10.0 109.898 174.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.467 ' CZ3' ' OXT' ' A' ' 78' ' ' LYS . 63.4 m95 -96.68 -35.06 11.15 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.719 1.608 . . . . 10.0 111.095 -179.368 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.07 -52.64 19.14 Favored Pre-proline 0 CA--C 1.549 0.941 0 N-CA-C 114.694 1.368 . . . . 10.0 114.694 169.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -74.83 16.18 0.66 Allowed 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.933 2.422 . . . . 10.0 113.641 -179.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.409 ' C ' ' H ' ' A' ' 36' ' ' ALA . 2.2 mmt180 -122.07 -45.05 2.26 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.78 2.032 . . . . 10.0 108.827 176.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.41 0.96 0.09 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.054 1.742 . . . . 10.0 114.433 166.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.409 ' H ' ' C ' ' A' ' 34' ' ' ARG . . . -81.11 -27.08 35.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.98 1.312 . . . . 10.0 109.842 174.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -90.42 -57.08 2.96 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.4 0.68 . . . . 10.0 110.492 173.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 148.9 -115.69 0.75 Allowed Glycine 0 CA--C 1.531 1.083 0 C-N-CA 123.845 0.736 . . . . 10.0 111.279 174.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.52 173.79 13.47 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.163 0 C-N-CA 125.064 1.346 . . . . 10.0 110.893 171.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.258 16.0 m-20 69.3 -27.51 0.16 Allowed 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 125.48 1.512 . . . . 10.0 112.877 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.67 -26.86 68.86 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.014 -1.678 . . . . 10.0 113.859 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -99.55 -38.51 8.73 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.623 0.769 . . . . 10.0 111.07 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -54.52 -33.99 27.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 122.015 -0.428 . . . . 10.0 110.25 172.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 ptmt -59.11 -46.97 86.96 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.916 1.08 . . . . 10.0 113.916 169.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 55.5 m -68.53 -28.38 66.93 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 120.59 -1.319 . . . . 10.0 110.547 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.3 t -60.24 -54.06 40.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 O-C-N 121.657 -0.652 . . . . 10.0 111.481 170.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -33.84 73.5 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 111.951 0.352 . . . . 10.0 111.951 177.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.03 -35.39 66.76 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.514 0.561 . . . . 10.0 112.514 -178.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.74 112.67 0.21 Allowed Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.255 -0.738 . . . . 10.0 111.255 -167.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.6 -155.23 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.578 0.751 . . . . 10.0 110.523 170.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -73.13 -66.58 0.66 Allowed 'General case' 0 N--CA 1.475 0.802 0 O-C-N 119.67 -1.894 . . . . 10.0 111.608 -173.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.31 -16.51 61.37 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.508 1.123 . . . . 10.0 112.118 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.2 ttp -100.77 118.05 61.45 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 123.237 0.615 . . . . 10.0 111.826 -172.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.02 154.3 70.92 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.115 1.876 . . . . 10.0 111.926 -173.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -59.58 124.8 16.22 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 123.991 3.127 . . . . 10.0 110.973 -177.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.89 43.03 8.49 Favored Glycine 0 C--N 1.34 0.793 0 CA-C-O 118.954 -0.914 . . . . 10.0 111.249 -172.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 17.6 57.73 0.01 OUTLIER Glycine 0 CA--C 1.531 1.088 0 C-N-CA 126.976 2.227 . . . . 10.0 115.422 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 72.34 -51.98 0.7 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.003 1.321 . . . . 10.0 112.972 -172.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.6 p -79.63 87.57 5.18 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 173.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 68.3 p -55.79 -50.07 71.47 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.399 -0.813 . . . . 10.0 111.124 171.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -78.32 63.24 3.16 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.824 1.65 . . . . 10.0 110.166 178.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 2.9 m -131.12 122.84 27.38 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.863 1.265 . . . . 10.0 111.073 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.0 m -90.83 141.72 28.52 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 124.765 1.226 . . . . 10.0 109.368 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -43.07 -38.18 2.25 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.32 1.23 . . . . 10.0 114.32 177.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -47.81 -58.52 4.25 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.225 1.01 . . . . 10.0 112.417 169.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -74.52 -40.87 61.48 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.901 1.281 . . . . 10.0 110.168 -178.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -57.09 14.08 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.024 0.929 . . . . 10.0 109.811 178.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -51.53 68.28 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.688 1.195 . . . . 10.0 110.036 -177.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.4 -33.76 55.08 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.354 -0.841 . . . . 10.0 112.709 170.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.58 -31.73 47.35 Favored 'General case' 0 C--N 1.341 0.222 0 O-C-N 121.013 -1.055 . . . . 10.0 111.487 -175.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -78.81 -50.42 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-O 121.775 0.797 . . . . 10.0 109.471 173.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -53.68 -31.71 48.88 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.203 1.401 . . . . 10.0 112.17 176.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -49.82 -58.08 6.09 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 124.568 1.147 . . . . 10.0 112.197 172.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.431 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 4.9 mpp? -64.17 -57.05 10.68 Favored 'General case' 0 C--N 1.34 0.194 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 177.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -177.09 129.45 0.17 Allowed 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.519 -1.289 . . . . 10.0 107.519 174.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.02 74.16 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.587 1.955 . . . . 10.0 113.185 172.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -163.99 -65.4 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.484 1.514 . . . . 10.0 113.757 -171.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.467 ' OXT' ' CZ3' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.712 0 N-CA-C 116.006 1.854 . . . . 10.0 116.006 -165.597 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.466 0.329 0 N-CA-C 114.123 1.157 . . . . 10.0 114.123 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -146.97 117.37 7.43 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 -177.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -45.2 -40.58 7.41 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.529 1.131 . . . . 10.0 113.743 173.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -60.48 -49.64 76.74 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.356 -0.215 . . . . 10.0 110.667 172.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.55 -30.69 70.4 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.557 -0.715 . . . . 10.0 111.303 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 15.8 mt -66.73 -52.79 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.56 -40.92 80.43 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 117.921 -1.511 . . . . 10.0 111.16 -179.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -69.04 -21.95 64.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.041 1.737 . . . . 10.0 113.273 -178.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.14 -29.08 15.33 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 121.21 -0.931 . . . . 10.0 113.172 168.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.72 -66.72 1.01 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.356 1.062 . . . . 10.0 112.78 -171.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.04 39.64 0.19 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.116 1.366 . . . . 10.0 110.757 179.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -125.12 3.37 7.92 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.797 1.239 . . . . 10.0 113.62 -167.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.3 t -105.84 -52.55 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 124.71 1.204 . . . . 10.0 108.249 -174.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.5 m -84.49 -62.53 1.53 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.559 1.544 . . . . 10.0 111.08 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 72.4 m-70 -73.92 -23.87 59.6 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.943 1.46 . . . . 10.0 114.943 -167.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.42 -46.78 87.76 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.152 0.581 . . . . 10.0 110.456 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -109.51 -22.21 12.1 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.847 0.859 . . . . 10.0 111.871 -176.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.46 57.34 1.88 Allowed Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.032 0.825 . . . . 10.0 112.019 -175.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 46.4 t -103.34 161.24 4.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 125.375 1.47 . . . . 10.0 109.396 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.33 22.05 10.38 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.089 0.956 . . . . 10.0 113.163 -175.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 73.69 16.4 79.17 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 124.157 0.884 . . . . 10.0 113.199 -173.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.15 144.18 98.15 Favored Pre-proline 0 CA--C 1.543 0.699 0 CA-C-N 118.262 1.031 . . . . 10.0 113.366 -174.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -76.28 139.1 20.75 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 124.249 3.299 . . . . 10.0 111.015 -176.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 mttt -62.54 143.81 56.79 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.524 0.564 . . . . 10.0 112.524 -165.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t -49.14 -35.29 16.19 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.436 1.094 . . . . 10.0 113.511 177.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -142.01 57.78 1.48 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.829 0.852 . . . . 10.0 112.277 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -79.35 165.46 23.11 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 165.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.2 p -107.95 -35.91 6.5 Favored 'General case' 0 C--O 1.222 -0.377 0 O-C-N 121.67 -0.643 . . . . 10.0 111.417 164.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.06 -22.01 56.13 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 120.557 -1.34 . . . . 10.0 113.203 -176.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -87.78 -23.4 24.08 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.396 2.278 . . . . 10.0 110.259 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.497 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 43.7 m95 -97.28 -36.8 10.29 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.053 1.741 . . . . 10.0 110.776 178.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -41.64 -59.79 2.26 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.27 1.428 . . . . 10.0 114.037 174.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -64.04 -10.87 24.75 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 122.613 2.209 . . . . 10.0 113.833 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -96.43 -47.77 5.84 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.506 1.122 . . . . 10.0 110.084 176.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -17.58 64.75 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.442 1.897 . . . . 10.0 112.407 179.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -82.36 -38.05 24.77 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 125.026 1.33 . . . . 10.0 109.097 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt -68.01 -49.76 59.61 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.534 171.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 162.59 -132.9 2.91 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 112.142 -0.383 . . . . 10.0 112.142 178.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.403 ' C ' ' H ' ' A' ' 41' ' ' ASN . 3.3 t -137.86 -54.02 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 C-N-CA 123.875 0.87 . . . . 10.0 109.975 179.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -74.38 34.5 0.09 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.456 1.502 . . . . 10.0 113.251 -177.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.403 ' H ' ' C ' ' A' ' 39' ' ' VAL . 2.4 m-20 -111.08 -54.74 2.57 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.762 2.425 . . . . 10.0 106.27 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -77.15 -32.52 56.35 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.481 -0.762 . . . . 10.0 110.552 -175.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.95 -15.3 16.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 O-C-N 121.929 -0.482 . . . . 10.0 111.566 171.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -85.96 -49.11 8.1 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.421 0.688 . . . . 10.0 111.102 168.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.8 m -58.59 -38.87 78.86 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 120.428 1.467 . . . . 10.0 110.64 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.7 p -62.0 -42.94 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-O 121.425 0.631 . . . . 10.0 110.963 -178.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.8 -30.42 51.23 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.762 0.825 . . . . 10.0 111.922 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 53.4 m -74.63 -25.45 59.23 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.438 1.095 . . . . 10.0 112.618 176.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.97 115.16 0.34 Allowed Glycine 0 CA--C 1.529 0.912 0 CA-C-N 119.486 1.039 . . . . 10.0 111.99 -175.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.3 tp -105.77 -145.74 0.38 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.518 0.727 . . . . 10.0 111.008 177.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -80.27 141.66 35.32 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 122.566 1.175 . . . . 10.0 108.768 174.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 55.72 22.09 5.16 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 112.183 -2.281 . . . . 10.0 111.953 173.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.6 ttp -144.64 123.3 6.84 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.516 1.127 . . . . 10.0 110.571 -174.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.45 148.39 48.29 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 121.881 1.721 . . . . 10.0 112.038 -173.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -62.95 113.66 2.1 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 123.648 2.899 . . . . 10.0 110.189 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 114.7 -10.6 21.31 Favored Glycine 0 CA--C 1.529 0.929 0 O-C-N 123.566 0.541 . . . . 10.0 112.668 -170.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.07 49.48 78.03 Favored Glycine 0 CA--C 1.534 1.234 0 O-C-N 120.429 -1.63 . . . . 10.0 109.999 -175.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 76.39 -45.54 0.51 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.462 1.905 . . . . 10.0 112.812 -177.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.0 p -76.86 159.57 29.94 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.215 -0.928 . . . . 10.0 111.279 177.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 34.1 p -110.05 -69.43 0.86 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.315 1.046 . . . . 10.0 110.38 -177.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -78.87 54.68 1.6 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.882 1.273 . . . . 10.0 110.602 -179.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -86.22 115.83 24.03 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.443 1.097 . . . . 10.0 111.086 -176.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 50.0 m -91.69 126.94 36.95 Favored 'General case' 0 C--O 1.231 0.09 0 N-CA-C 108.568 -0.901 . . . . 10.0 108.568 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -43.96 -34.4 1.68 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.299 1.439 . . . . 10.0 113.174 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -43.81 -66.78 0.34 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.464 1.105 . . . . 10.0 113.275 163.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.67 -29.24 62.2 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.329 -0.857 . . . . 10.0 110.081 -177.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.03 -52.62 64.19 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.807 0.813 . . . . 10.0 111.358 179.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -66.69 -47.1 73.49 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-O 117.804 -1.093 . . . . 10.0 109.296 176.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.15 -29.67 5.74 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 120.097 1.317 . . . . 10.0 113.524 171.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.24 -36.61 22.59 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.397 1.079 . . . . 10.0 112.131 -177.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.0 mt -81.63 -47.55 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.86 1.264 . . . . 10.0 111.8 176.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.25 -34.7 33.61 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.336 1.454 . . . . 10.0 112.443 172.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -44.24 -39.71 4.64 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.785 0.834 . . . . 10.0 112.523 173.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.497 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -82.5 -70.43 0.55 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 122.771 0.428 . . . . 10.0 111.962 -178.456 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 t -161.34 32.48 0.14 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.674 0.79 . . . . 10.0 112.488 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.8 pttt 36.94 57.74 1.17 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.457 1.503 . . . . 10.0 114.588 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.05 -52.65 0.37 Allowed 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 113.841 1.052 . . . . 10.0 113.841 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.449 ' NZ ' ' O ' ' A' ' 78' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.911 0 C-N-CA 125.165 1.386 . . . . 10.0 113.443 -166.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.532 0.266 0 N-CA-C 114.165 1.172 . . . . 10.0 114.165 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.448 ' CG ' ' H ' ' A' ' 3' ' ' ALA . 15.6 t70 -144.47 -153.39 0.47 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.958 1.303 . . . . 10.0 108.321 -174.184 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.448 ' H ' ' CG ' ' A' ' 2' ' ' ASP . . . -127.82 -40.4 1.72 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 128.335 2.654 . . . . 10.0 111.443 177.148 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -56.49 -46.69 80.35 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.449 0.642 . . . . 10.0 110.47 175.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.96 -31.52 72.15 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.877 -0.514 . . . . 10.0 110.746 -178.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.3 mp -69.3 -52.34 34.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 N-CA-C 107.983 -1.117 . . . . 10.0 107.983 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.427 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -68.27 -39.47 82.15 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 118.181 -1.408 . . . . 10.0 111.325 -179.148 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -69.39 -22.83 63.68 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.204 1.402 . . . . 10.0 113.003 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.64 -30.98 16.04 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.667 0.988 . . . . 10.0 113.667 167.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.01 -64.89 1.21 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.24 1.016 . . . . 10.0 111.946 -166.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.427 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.74 41.2 0.2 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.627 1.171 . . . . 10.0 110.912 177.43 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -128.81 0.25 5.39 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 125.66 1.584 . . . . 10.0 113.631 -166.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.5 t -101.97 -51.11 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 124.62 1.168 . . . . 10.0 108.199 -176.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.6 m -88.67 -64.1 1.2 Allowed 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.119 1.768 . . . . 10.0 109.933 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.3 m-70 -73.65 -11.19 60.34 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.05 1.5 . . . . 10.0 115.05 -166.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.35 -36.68 63.62 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.124 0.97 . . . . 10.0 110.908 178.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -125.23 -37.42 2.4 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.753 1.221 . . . . 10.0 112.24 -172.419 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.35 64.15 1.17 Allowed Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.75 1.643 . . . . 10.0 112.909 175.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 73.5 t -84.67 -56.66 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 123.657 0.783 . . . . 10.0 111.925 -176.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.1 33.23 0.44 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.941 0.897 . . . . 10.0 111.128 177.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 63.59 21.8 65.25 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 124.497 1.046 . . . . 10.0 113.258 -174.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.97 137.95 97.14 Favored Pre-proline 0 CA--C 1.545 0.756 0 O-C-N 121.813 -0.816 . . . . 10.0 112.564 -174.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -70.08 135.55 29.96 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.645 2.897 . . . . 10.0 110.3 -175.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.5 mtmm -53.58 133.62 41.26 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.155 -0.966 . . . . 10.0 112.578 -171.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.4 p -55.68 -14.16 2.07 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.824 1.046 . . . . 10.0 113.824 173.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -145.82 45.65 1.27 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.436 1.094 . . . . 10.0 111.848 177.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -76.64 167.95 20.94 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.407 -0.808 . . . . 10.0 109.82 166.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.7 t -109.15 -35.65 6.25 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.875 -0.516 . . . . 10.0 111.53 161.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.83 -21.14 51.94 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.181 -1.574 . . . . 10.0 113.345 -174.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.77 -26.69 31.63 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.08 2.152 . . . . 10.0 110.006 177.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.493 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 41.0 m95 -94.5 -36.34 11.9 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.841 1.656 . . . . 10.0 110.846 -177.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -45.33 -56.78 8.66 Favored Pre-proline 0 CA--C 1.545 0.778 0 O-C-N 120.811 -1.181 . . . . 10.0 113.635 174.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -76.47 21.57 0.55 Allowed 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.167 2.578 . . . . 10.0 113.133 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -125.37 -47.98 1.71 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.582 1.953 . . . . 10.0 109.02 175.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -19.66 47.14 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.799 2.44 . . . . 10.0 112.036 173.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.41 -28.45 37.81 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 124.526 1.131 . . . . 10.0 110.124 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.6 mmmt -74.93 -51.26 14.23 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 174.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.468 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 158.3 -117.34 0.77 Allowed Glycine 0 CA--C 1.531 1.06 0 C-N-CA 124.686 1.136 . . . . 10.0 110.403 177.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.446 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -144.01 -56.64 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 124.294 1.038 . . . . 10.0 110.764 177.606 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.49 17.17 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.486 1.115 . . . . 10.0 113.371 -176.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.468 HD22 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -97.89 -22.97 16.04 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 125.754 1.621 . . . . 10.0 110.526 177.428 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -104.43 -43.14 5.26 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.338 1.055 . . . . 10.0 110.031 -175.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -54.36 -33.22 25.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 O-C-N 121.72 -0.613 . . . . 10.0 111.151 171.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -63.68 -43.45 96.63 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.217 -0.927 . . . . 10.0 113.112 172.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.7 m -66.16 -34.15 77.4 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.203 -0.935 . . . . 10.0 110.371 177.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 31.3 t -56.87 -54.86 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 122.491 0.317 . . . . 10.0 110.995 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -35.08 68.91 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.952 0.723 . . . . 10.0 112.952 175.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 22.6 m -71.58 -36.13 70.78 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.05 0.54 . . . . 10.0 111.999 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.48 95.68 0.6 Allowed Glycine 0 CA--C 1.528 0.904 0 CA-C-N 118.862 0.756 . . . . 10.0 111.23 -174.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.1 tp -60.13 169.39 1.58 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 122.138 0.971 . . . . 10.0 111.839 173.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.416 ' H ' ' ND2' ' A' ' 51' ' ' ASN . 13.7 m-80 -50.32 -55.95 13.35 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.71 -1.244 . . . . 10.0 112.603 -174.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -95.29 20.39 9.36 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 113.799 -1.546 . . . . 10.0 112.073 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 39.7 ttp -129.08 130.63 23.42 Favored Pre-proline 0 CA--C 1.551 1.019 0 N-CA-C 114.478 1.288 . . . . 10.0 114.478 175.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -64.02 157.43 53.1 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 121.992 1.794 . . . . 10.0 112.182 177.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -60.12 137.0 72.66 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.791 2.327 . . . . 10.0 110.118 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 62.16 27.9 69.8 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-O 118.927 -0.93 . . . . 10.0 113.756 -175.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 48.21 33.85 11.63 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.128 1.347 . . . . 10.0 113.782 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 71.15 45.58 0.49 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.973 1.309 . . . . 10.0 112.077 -175.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.8 t -125.5 -52.6 1.6 Allowed 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.592 -0.693 . . . . 10.0 111.669 163.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.9 m 70.2 -69.47 0.17 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.993 1.317 . . . . 10.0 110.818 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -84.16 55.06 3.17 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.878 0.871 . . . . 10.0 110.699 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.3 m -114.65 140.56 48.73 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.354 1.462 . . . . 10.0 109.644 173.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 59.9 m -101.78 146.55 27.62 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.525 1.13 . . . . 10.0 109.492 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -41.92 -39.84 1.97 Allowed 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 115.063 1.505 . . . . 10.0 115.063 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -42.71 -63.59 0.76 Allowed 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.758 1.163 . . . . 10.0 112.607 167.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.82 -40.05 63.62 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.541 1.936 . . . . 10.0 109.613 -175.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -59.12 5.83 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.923 0.889 . . . . 10.0 110.065 178.02 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt -59.16 -46.29 88.77 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.525 1.13 . . . . 10.0 109.411 178.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.01 -26.48 37.28 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.3 -0.875 . . . . 10.0 112.415 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.85 -6.64 57.2 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 125.212 1.405 . . . . 10.0 112.648 -174.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.51 -40.27 4.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 125.447 1.499 . . . . 10.0 110.335 167.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.81 -40.71 76.47 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.71 0.804 . . . . 10.0 111.108 175.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -52.64 -36.8 57.34 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.893 0.701 . . . . 10.0 112.893 176.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.493 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 2.6 mpp? -75.3 -66.03 0.82 Allowed 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 121.819 -0.55 . . . . 10.0 111.562 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -166.53 35.37 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 119.569 -0.853 . . . . 10.0 112.519 -178.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt 37.29 51.65 1.13 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.861 0.864 . . . . 10.0 113.301 -176.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -141.3 -82.93 0.21 Allowed 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.012 1.116 . . . . 10.0 114.012 170.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.489 ' NZ ' ' O ' ' A' ' 78' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.984 0 N-CA-C 115.733 1.753 . . . . 10.0 115.733 -164.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 . . . . . 0 N--CA 1.461 0.11 0 N-CA-C 113.081 0.771 . . . . 10.0 113.081 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -141.24 127.42 19.65 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.995 -1.113 . . . . 10.0 107.995 172.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.96 -36.99 75.75 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.965 0.906 . . . . 10.0 112.003 175.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -61.94 -48.41 80.53 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 120.401 -0.52 . . . . 10.0 110.934 172.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.08 -31.0 71.61 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 121.34 -0.85 . . . . 10.0 109.848 -177.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 mm -65.77 -52.78 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 117.698 -1.144 . . . . 10.0 109.248 173.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -68.17 -39.55 82.52 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 121.258 1.844 . . . . 10.0 112.153 -178.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -69.74 -22.32 63.38 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.288 2.235 . . . . 10.0 111.926 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.89 -27.12 15.33 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.035 1.124 . . . . 10.0 114.035 166.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -104.98 -70.67 0.77 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.131 1.372 . . . . 10.0 112.557 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.49 42.07 0.27 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.937 1.695 . . . . 10.0 110.418 -178.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.0 t -127.48 -5.49 5.91 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 125.172 1.389 . . . . 10.0 113.677 -164.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 42.1 t -95.87 -53.5 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 CA-C-O 122.311 1.053 . . . . 10.0 108.167 -175.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 29.2 m -93.04 -55.24 3.41 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.525 1.53 . . . . 10.0 109.261 -171.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -72.76 -19.8 61.3 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.677 1.191 . . . . 10.0 113.334 -172.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.9 t -63.62 -49.6 72.67 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.18 0.592 . . . . 10.0 110.879 -178.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.7 tpt -112.08 -27.21 8.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.332 1.053 . . . . 10.0 112.977 -177.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.64 58.62 2.01 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 124.781 1.181 . . . . 10.0 112.859 -177.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 96.2 t -82.63 -58.22 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 121.898 -0.766 . . . . 10.0 112.204 -175.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.55 32.01 0.41 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.873 0.869 . . . . 10.0 111.044 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 63.62 23.91 67.44 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 123.747 0.689 . . . . 10.0 112.832 -172.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.94 145.15 97.71 Favored Pre-proline 0 CA--C 1.544 0.731 0 O-C-N 121.769 -0.842 . . . . 10.0 111.142 176.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.94 144.86 35.01 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.73 2.953 . . . . 10.0 110.873 -174.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -65.53 138.31 57.97 Favored 'General case' 0 C--O 1.239 0.534 0 O-C-N 121.796 -0.565 . . . . 10.0 111.897 -171.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.6 m -19.58 -51.26 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 128.189 2.596 . . . . 10.0 115.206 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -144.68 53.1 1.24 Allowed 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.999 0.428 . . . . 10.0 111.45 173.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -53.34 153.79 3.73 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.348 -0.845 . . . . 10.0 110.105 164.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 94.2 m -100.6 -35.56 9.46 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.203 -0.936 . . . . 10.0 111.001 169.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.09 -23.37 28.53 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 120.966 -1.084 . . . . 10.0 112.595 -171.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -81.71 -32.88 31.43 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.119 1.768 . . . . 10.0 109.768 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 43.6 m95 -85.08 -35.45 21.82 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.313 1.845 . . . . 10.0 111.459 178.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -42.64 -58.77 3.43 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 114.349 1.24 . . . . 10.0 114.349 174.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -73.27 15.58 0.5 Allowed 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 123.209 2.606 . . . . 10.0 113.743 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.03 -49.71 2.5 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.81 1.644 . . . . 10.0 108.95 173.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.9 mt -54.65 -12.01 0.68 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.407 1.483 . . . . 10.0 114.38 170.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.91 -37.16 16.69 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 125.117 1.367 . . . . 10.0 110.019 -173.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.0 mtpt -77.98 -47.07 19.37 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 166.63 -126.2 1.43 Allowed Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.892 -0.883 . . . . 10.0 110.892 173.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 86.5 t -138.62 -64.57 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 C-N-CA 123.399 0.68 . . . . 10.0 110.96 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.13 -35.7 59.99 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 119.065 -0.493 . . . . 10.0 111.373 -174.244 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -33.68 -42.22 0.11 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.742 1.217 . . . . 10.0 112.566 171.124 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -81.37 -42.6 20.25 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.744 1.218 . . . . 10.0 112.524 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -53.52 -33.95 22.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 O-C-N 121.078 -1.014 . . . . 10.0 110.981 169.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -44.31 96.98 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.394 -0.817 . . . . 10.0 112.622 169.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.6 m -61.47 -37.32 83.19 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 120.598 -1.314 . . . . 10.0 110.249 174.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 7.0 t -63.6 -55.1 24.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 122.866 0.466 . . . . 10.0 111.592 -178.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.03 -32.62 64.19 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 176.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.3 m -72.23 -30.0 64.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.936 0.895 . . . . 10.0 112.077 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 74.97 94.64 0.14 Allowed Glycine 0 CA--C 1.53 0.983 0 CA-C-N 118.98 0.809 . . . . 10.0 111.903 -176.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.2 tp -65.0 170.5 4.32 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.93 -0.747 . . . . 10.0 111.696 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -48.84 -58.19 5.21 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.612 -1.305 . . . . 10.0 112.946 -170.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.03 24.92 5.14 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.15 1.38 . . . . 10.0 112.768 173.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 35.3 ttp -132.01 127.19 21.0 Favored Pre-proline 0 CA--C 1.554 1.097 0 N-CA-C 114.5 1.296 . . . . 10.0 114.5 172.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.09 157.34 53.89 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 122.035 1.823 . . . . 10.0 112.937 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -64.78 129.92 24.74 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 123.663 2.908 . . . . 10.0 110.593 -175.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.02 25.46 74.67 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 121.575 -0.345 . . . . 10.0 112.429 -170.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.16 -46.3 2.7 Favored Glycine 0 CA--C 1.534 1.24 0 O-C-N 121.369 -1.077 . . . . 10.0 114.178 170.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -174.13 -48.27 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.387 2.275 . . . . 10.0 109.997 171.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.8 t -79.56 131.49 36.03 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.724 1.61 . . . . 10.0 110.9 177.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.5 m -89.54 -50.0 6.35 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 122.027 0.917 . . . . 10.0 110.212 173.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -78.88 60.6 2.9 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.725 2.41 . . . . 10.0 110.064 179.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 21.4 m -134.3 148.32 50.75 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.98 1.712 . . . . 10.0 110.615 174.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 59.4 m -108.93 155.78 20.45 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.639 1.576 . . . . 10.0 109.859 -178.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -46.17 -40.66 11.51 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.438 1.095 . . . . 10.0 112.99 177.326 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -57.12 -47.47 81.02 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.611 -0.68 . . . . 10.0 111.868 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.32 -44.07 63.22 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.812 -0.811 . . . . 10.0 108.812 -179.41 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -55.71 -49.95 71.63 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.266 0.555 . . . . 10.0 111.955 176.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -67.75 -52.55 36.07 Favored 'General case' 0 C--O 1.218 -0.603 0 CA-C-O 118.071 -0.966 . . . . 10.0 108.777 -176.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.39 -39.3 15.01 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.736 1.153 . . . . 10.0 112.859 171.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.05 -50.26 50.11 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.387 -0.821 . . . . 10.0 110.825 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 51.2 mt -58.31 -37.74 65.04 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.026 0 C-N-CA 125.498 1.519 . . . . 10.0 112.212 172.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -68.41 -38.22 81.05 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 126.778 2.031 . . . . 10.0 111.596 175.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -52.03 -36.18 49.35 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.538 0.57 . . . . 10.0 112.538 172.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 66.1 mtm -80.45 -71.97 0.43 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.777 0.831 . . . . 10.0 112.633 -179.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 7.0 t -162.96 45.59 0.13 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.742 -0.599 . . . . 10.0 111.78 172.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.2 ptpt 36.11 57.98 0.99 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.048 1.739 . . . . 10.0 114.948 176.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.21 -80.01 0.04 OUTLIER 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 112.425 0.528 . . . . 10.0 112.425 171.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.254 1.312 0 N-CA-C 116.005 1.854 . . . . 10.0 116.005 -169.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.338 0 N-CA-C 111.95 0.352 . . . . 10.0 111.95 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -143.85 125.22 14.72 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.775 1.23 . . . . 10.0 108.217 172.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -49.54 -39.24 33.84 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.36 1.064 . . . . 10.0 112.558 170.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -59.97 -45.06 93.92 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 122.365 -0.209 . . . . 10.0 111.175 171.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.6 -34.25 76.63 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.366 -0.834 . . . . 10.0 110.667 -179.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.6 mt -64.37 -52.75 51.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 N-CA-C 108.432 -0.951 . . . . 10.0 108.432 178.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.41 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.65 -39.83 76.85 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 117.962 -1.495 . . . . 10.0 111.998 -178.147 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -68.46 -22.6 64.56 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.118 1.367 . . . . 10.0 112.45 -177.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.65 -28.73 15.82 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.444 0.905 . . . . 10.0 113.444 170.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.03 -67.7 0.96 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.854 0.862 . . . . 10.0 112.373 -171.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.41 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.78 45.07 0.4 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 125.119 1.368 . . . . 10.0 110.159 -178.574 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.9 t -125.91 -15.13 5.98 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 120.495 -1.378 . . . . 10.0 113.859 -162.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -95.02 -30.36 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.596 1.158 . . . . 10.0 109.1 -175.328 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 96.1 m -107.4 -64.12 1.23 Allowed 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 128.254 2.622 . . . . 10.0 109.624 -173.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -74.8 -19.38 60.22 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.929 1.085 . . . . 10.0 113.929 -168.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.8 t -61.88 -50.67 71.27 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.502 0.721 . . . . 10.0 110.891 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.6 mmt -109.15 -13.96 14.58 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.311 1.444 . . . . 10.0 112.731 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.91 45.6 7.59 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.43 1.014 . . . . 10.0 112.087 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 91.9 t -90.52 159.88 2.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 124.855 1.262 . . . . 10.0 109.512 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.11 19.0 5.66 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.677 1.191 . . . . 10.0 113.754 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.62 7.38 75.46 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.555 1.074 . . . . 10.0 113.804 -175.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.53 147.87 96.83 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 118.403 1.101 . . . . 10.0 113.234 -172.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -68.46 164.09 34.1 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 123.677 2.918 . . . . 10.0 110.351 174.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -84.76 142.68 29.64 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.523 -0.736 . . . . 10.0 111.919 -176.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -45.84 -28.06 1.0 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.449 1.5 . . . . 10.0 113.837 172.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -135.31 125.01 25.28 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.867 0.867 . . . . 10.0 109.282 164.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -155.03 157.86 38.25 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.374 1.87 . . . . 10.0 106.496 172.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 75.7 m -108.39 -36.41 6.25 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.728 0.695 . . . . 10.0 111.464 171.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.28 -29.55 53.87 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.379 -0.825 . . . . 10.0 112.205 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -75.98 -34.58 59.77 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.392 1.477 . . . . 10.0 110.177 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.426 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 58.9 m95 -84.7 -34.06 23.02 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.752 2.021 . . . . 10.0 112.024 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -39.01 -61.73 0.89 Allowed Pre-proline 0 CA--C 1.546 0.797 0 N-CA-C 114.719 1.377 . . . . 10.0 114.719 173.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.32 -16.62 52.49 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.766 2.311 . . . . 10.0 113.265 -177.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.4 mmt180 -87.5 -51.68 5.78 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.886 1.274 . . . . 10.0 109.269 -179.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.36 -17.53 30.72 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.509 1.524 . . . . 10.0 113.413 174.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.16 -38.6 12.05 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 125.479 1.511 . . . . 10.0 109.97 -173.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -62.25 -51.67 66.79 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.145 -0.48 . . . . 10.0 109.806 167.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.7 -129.85 2.24 Favored Glycine 0 CA--C 1.533 1.174 0 N-CA-C 111.092 -0.803 . . . . 10.0 111.092 176.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.409 ' C ' ' H ' ' A' ' 41' ' ' ASN . 5.2 t -134.05 -58.03 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 123.848 0.859 . . . . 10.0 109.663 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.87 19.09 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.891 1.676 . . . . 10.0 114.63 -175.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.409 ' H ' ' C ' ' A' ' 39' ' ' VAL . 1.2 m-20 -97.4 -26.22 14.94 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 127.591 2.356 . . . . 10.0 110.189 174.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -94.58 -47.48 6.51 Favored 'General case' 0 N--CA 1.445 -0.675 0 C-N-CA 123.694 0.797 . . . . 10.0 109.736 -175.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -51.93 -32.92 15.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.657 1.183 . . . . 10.0 112.29 173.041 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -71.38 -37.56 71.57 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 120.427 -1.42 . . . . 10.0 112.838 172.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.6 t -75.87 -36.06 59.67 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.582 1.553 . . . . 10.0 110.996 -175.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.8 p -65.92 -48.27 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 O-C-N 121.408 -0.807 . . . . 10.0 110.852 168.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -34.51 76.13 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.954 -0.698 . . . . 10.0 111.266 -176.049 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.2 t -74.95 -32.61 61.78 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.798 -0.564 . . . . 10.0 112.018 174.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.5 112.1 1.0 Allowed Glycine 0 CA--C 1.532 1.144 0 C-N-CA 123.904 0.764 . . . . 10.0 112.684 -173.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.61 -175.51 4.39 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.68 0.792 . . . . 10.0 110.835 169.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -55.02 -64.44 0.83 Allowed 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.308 -1.495 . . . . 10.0 113.706 -162.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.52 8.1 6.98 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 115.598 -0.728 . . . . 10.0 112.5 173.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.19 138.91 19.68 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 114.113 1.153 . . . . 10.0 114.113 -175.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.38 140.42 52.76 Favored 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.094 1.862 . . . . 10.0 110.966 174.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -65.05 102.43 0.44 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.458 2.772 . . . . 10.0 109.649 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 110.35 12.37 17.54 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.342 0.496 . . . . 10.0 113.435 -175.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 56.15 34.75 62.91 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 118.663 1.232 . . . . 10.0 111.876 -177.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 73.59 -7.08 1.64 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.202 2.201 . . . . 10.0 114.074 -177.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.4 t -106.03 114.3 28.36 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.889 0.768 . . . . 10.0 112.113 -173.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 32.4 p -72.48 -53.4 12.22 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.321 1.048 . . . . 10.0 110.892 175.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -101.31 77.18 1.77 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.699 2.0 . . . . 10.0 109.024 177.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 12.0 m -123.87 132.63 53.79 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 121.572 -0.705 . . . . 10.0 110.844 161.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.8 p -79.25 163.27 25.09 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 122.159 -0.338 . . . . 10.0 110.198 171.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.98 -40.48 73.34 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.635 -0.666 . . . . 10.0 112.546 168.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.26 -51.83 63.31 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.728 0.695 . . . . 10.0 110.585 175.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -72.62 -36.6 68.11 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 122.23 -0.294 . . . . 10.0 111.34 -177.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -61.32 -52.17 65.81 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.749 -1.219 . . . . 10.0 111.334 173.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -63.37 -46.88 84.47 Favored 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 123.922 0.889 . . . . 10.0 109.823 -177.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.24 -40.86 49.01 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 121.323 0.582 . . . . 10.0 112.221 168.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.5 -39.82 70.57 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.865 -1.147 . . . . 10.0 112.051 -178.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.59 -55.49 19.58 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 124.078 0.951 . . . . 10.0 111.295 171.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -23.07 65.92 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 120.906 -1.121 . . . . 10.0 113.65 -177.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -43.69 -48.12 7.84 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.066 0.848 . . . . 10.0 111.364 168.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.426 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 3.6 mpp? -72.05 -50.02 31.86 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 112.228 0.455 . . . . 10.0 112.228 -179.249 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.84 -75.37 0.15 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.996 -0.526 . . . . 10.0 112.071 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 155.6 50.95 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 129.582 3.153 . . . . 10.0 111.589 -177.377 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -164.26 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.344 1.239 . . . . 10.0 114.344 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.27 0 N-CA-C 114.855 1.428 . . . . 10.0 114.855 -176.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 115.906 1.817 . . . . 10.0 115.906 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.427 ' CG ' ' H ' ' A' ' 3' ' ' ALA . 14.5 t70 -147.53 -160.4 1.16 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.563 1.545 . . . . 10.0 107.664 -174.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.427 ' H ' ' CG ' ' A' ' 2' ' ' ASP . . . -117.51 -40.2 3.08 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 128.609 2.764 . . . . 10.0 111.469 177.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.21 -46.85 82.53 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.239 0.542 . . . . 10.0 110.203 174.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.9 -29.33 69.19 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.72 -0.613 . . . . 10.0 110.91 -175.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.1 mp -67.92 -53.0 33.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 108.236 -1.024 . . . . 10.0 108.236 177.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.4 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.6 OUTLIER -68.44 -40.52 81.11 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 117.309 -1.756 . . . . 10.0 111.359 -178.762 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -69.61 -22.62 63.48 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.62 1.568 . . . . 10.0 113.164 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -96.38 -28.7 14.34 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.679 0.992 . . . . 10.0 113.679 170.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.47 -64.27 1.27 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.571 0.748 . . . . 10.0 112.011 -168.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.4 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.1 OUTLIER -73.92 29.13 0.08 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.591 1.157 . . . . 10.0 111.837 177.737 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -110.23 5.2 21.63 Favored 'General case' 0 CA--C 1.522 -0.124 0 O-C-N 120.583 -1.323 . . . . 10.0 113.984 -163.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 23.9 t -107.08 -44.4 7.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 125.048 1.339 . . . . 10.0 108.976 -172.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.7 m -95.85 -63.43 1.15 Allowed 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.92 2.088 . . . . 10.0 111.313 -177.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 35.9 m-70 -73.82 -23.26 59.63 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.606 0.965 . . . . 10.0 113.606 -167.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.1 t -58.47 -45.97 87.58 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.566 1.146 . . . . 10.0 111.041 -178.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 25.9 mmt -111.78 -20.55 12.03 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.983 1.313 . . . . 10.0 112.68 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.87 48.32 3.67 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 123.823 0.725 . . . . 10.0 112.16 -176.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 74.4 t -92.94 161.54 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 C-N-CA 125.107 1.363 . . . . 10.0 109.26 177.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.64 20.04 5.97 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.589 1.156 . . . . 10.0 113.328 -174.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 71.95 26.37 72.72 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.219 0.914 . . . . 10.0 113.293 -173.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.69 144.19 76.48 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 113.926 1.084 . . . . 10.0 113.926 -176.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -80.24 124.06 5.25 Favored 'Trans proline' 0 CA--C 1.537 0.646 1 C-N-CA 125.475 4.117 . . . . 10.0 111.759 -174.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -57.39 141.85 45.79 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 125.115 1.366 . . . . 10.0 112.485 -160.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.7 m -49.86 -56.94 8.52 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.532 0.568 . . . . 10.0 112.532 175.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -108.48 94.43 5.06 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 122.147 0.975 . . . . 10.0 111.098 178.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -135.72 166.5 23.13 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.226 1.41 . . . . 10.0 108.136 176.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.4 m -107.25 -38.59 5.93 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 118.259 0.482 . . . . 10.0 111.164 169.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.4 -16.15 47.02 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 120.868 -1.145 . . . . 10.0 113.22 -174.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -89.12 -23.49 22.47 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.199 1.8 . . . . 10.0 110.395 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 81.1 m95 -96.62 -36.0 10.87 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 126.443 1.897 . . . . 10.0 111.631 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -42.16 -58.64 3.28 Favored Pre-proline 0 CA--C 1.549 0.915 0 N-CA-C 114.436 1.272 . . . . 10.0 114.436 172.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.14 15.54 0.75 Allowed 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.517 2.812 . . . . 10.0 113.397 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.401 ' C ' ' H ' ' A' ' 36' ' ' ALA . 5.4 mmt85 -116.62 -45.42 2.8 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.555 1.542 . . . . 10.0 108.599 176.146 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.51 3.91 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.738 2.015 . . . . 10.0 114.916 165.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.401 ' H ' ' C ' ' A' ' 34' ' ' ARG . . . -87.02 -30.07 21.49 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.55 1.14 . . . . 10.0 110.289 177.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? -88.66 -56.04 3.46 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.902 0.481 . . . . 10.0 110.056 174.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.63 -122.33 1.11 Allowed Glycine 0 CA--C 1.531 1.089 0 C-N-CA 124.492 1.044 . . . . 10.0 110.526 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.5 -58.48 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 C-N-CA 124.181 0.992 . . . . 10.0 110.929 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.73 35.54 0.13 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.604 1.562 . . . . 10.0 113.369 -170.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -113.04 -57.65 2.26 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 128.017 2.527 . . . . 10.0 107.514 179.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mt -67.23 -29.5 69.16 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.916 1.286 . . . . 10.0 110.263 -175.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -55.69 -17.61 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 126.04 1.736 . . . . 10.0 113.743 168.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.9 mtmt -93.23 -43.38 8.85 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 172.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.4 m -61.8 -32.3 72.58 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.121 0.962 . . . . 10.0 109.749 177.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.5 p -69.9 -38.52 75.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 170.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.4 -32.77 68.8 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.344 -0.848 . . . . 10.0 112.443 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.1 t -75.47 -36.64 60.61 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.819 0.848 . . . . 10.0 113.211 173.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 82.77 117.66 0.56 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.607 -0.597 . . . . 10.0 111.607 -167.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.29 -150.87 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.268 0.627 . . . . 10.0 110.062 164.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -75.95 -67.23 0.7 Allowed 'General case' 0 N--CA 1.476 0.834 0 O-C-N 119.482 -2.011 . . . . 10.0 112.156 -172.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.68 -12.35 59.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.899 1.279 . . . . 10.0 111.919 174.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 mmm -78.24 129.31 75.62 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.151 0.58 . . . . 10.0 111.497 172.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.28 145.45 59.99 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 121.685 1.59 . . . . 10.0 110.071 176.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -61.59 130.06 30.2 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.656 2.237 . . . . 10.0 109.736 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.76 26.7 66.57 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 119.397 -1.382 . . . . 10.0 112.051 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 40.91 34.99 0.86 Allowed Glycine 0 CA--C 1.534 1.264 0 C-N-CA 126.123 1.821 . . . . 10.0 115.903 177.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.72 38.21 18.46 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.758 1.223 . . . . 10.0 112.868 -175.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -126.84 147.91 50.01 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.702 2.001 . . . . 10.0 109.666 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.7 m -116.15 -77.93 0.57 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.341 0.657 . . . . 10.0 110.245 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -79.1 46.3 0.69 Allowed 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.55 1.14 . . . . 10.0 111.055 -173.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 4.5 m -125.52 138.69 53.98 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.171 1.788 . . . . 10.0 110.918 -166.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 45.8 m -112.17 -103.33 0.4 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.979 0.809 . . . . 10.0 109.948 -171.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -139.74 -48.42 0.46 Allowed 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 124.568 1.147 . . . . 10.0 109.011 -178.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -43.84 -60.27 1.89 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 120.325 1.421 . . . . 10.0 113.854 175.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -74.32 -29.93 61.83 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.596 0.712 . . . . 10.0 110.217 -178.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -44.85 95.67 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.226 -0.921 . . . . 10.0 113.058 177.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -62.35 -56.34 19.28 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 124.547 1.139 . . . . 10.0 108.373 174.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.42 -33.34 30.07 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.76 -47.25 75.86 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.242 -0.911 . . . . 10.0 111.829 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -57.01 -47.83 82.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.702 0.801 . . . . 10.0 111.119 170.048 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -64.38 -36.39 83.98 Favored 'General case' 0 C--O 1.228 -0.074 0 O-C-N 121.243 -0.911 . . . . 10.0 113.192 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -49.57 -49.69 45.36 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.728 0.695 . . . . 10.0 111.088 176.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 75.8 mtm -66.45 -45.16 80.74 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.996 0.518 . . . . 10.0 112.39 -179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.56 -71.79 0.09 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 118.774 -0.632 . . . . 10.0 112.566 172.477 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt 152.21 57.87 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 130.073 3.349 . . . . 10.0 112.106 -178.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -170.56 -75.52 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 114.505 1.298 . . . . 10.0 114.505 170.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.3 pttp . . . . . 0 C--O 1.254 1.303 0 C-N-CA 125.666 1.586 . . . . 10.0 114.626 -172.571 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 . . . . . 0 N--CA 1.464 0.271 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -149.43 112.93 5.0 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.64 0.776 . . . . 10.0 110.027 178.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -32.17 -46.65 0.13 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.816 2.046 . . . . 10.0 115.158 162.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.0 tt0 -58.66 -48.58 80.58 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 118.833 0.742 . . . . 10.0 110.724 173.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.46 -33.98 76.23 Favored 'General case' 0 C--O 1.226 -0.159 0 O-C-N 121.893 -0.504 . . . . 10.0 110.327 -177.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.7 mm -65.83 -51.0 66.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-O 118.459 -0.781 . . . . 10.0 109.212 176.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.425 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -67.8 -40.41 83.89 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 117.686 -1.605 . . . . 10.0 111.445 -179.656 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -68.88 -23.38 64.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.389 1.476 . . . . 10.0 112.957 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -27.85 15.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.985 1.314 . . . . 10.0 112.831 171.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.71 -65.81 1.15 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.76 1.224 . . . . 10.0 113.456 -172.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.425 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.94 45.58 0.35 Allowed 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 124.159 0.984 . . . . 10.0 110.148 179.731 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.0 t -129.22 -15.14 4.21 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 120.459 -1.401 . . . . 10.0 113.856 -162.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 19.6 m -97.59 -42.83 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 C-N-CA 124.185 0.994 . . . . 10.0 109.552 -177.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.7 m -85.8 -64.34 1.17 Allowed 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 126.831 2.052 . . . . 10.0 110.262 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -73.49 -26.1 60.74 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.637 0.977 . . . . 10.0 113.637 -165.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.0 t -56.06 -49.27 74.24 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.896 0.878 . . . . 10.0 111.136 -178.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.0 mmt -112.88 -9.21 13.66 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.726 0.81 . . . . 10.0 112.445 -178.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.61 42.88 8.12 Favored Glycine 0 CA--C 1.533 1.197 0 O-C-N 121.575 -0.703 . . . . 10.0 111.896 -179.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 50.1 t -88.89 161.27 2.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 125.081 1.352 . . . . 10.0 109.12 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.7 18.16 4.59 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.42 1.088 . . . . 10.0 113.933 -175.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 84.54 11.55 77.35 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.69 1.138 . . . . 10.0 113.787 -176.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.08 152.09 94.78 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-N 118.702 1.251 . . . . 10.0 113.757 -174.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -76.75 138.42 18.92 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.12 2.546 . . . . 10.0 110.83 -176.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.62 127.38 22.73 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.226 1.01 . . . . 10.0 113.008 -173.356 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 91.0 p 0.84 -82.39 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 128.15 2.58 . . . . 10.0 115.349 171.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.6 p80 -144.66 110.95 5.55 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 122.073 0.939 . . . . 10.0 110.051 170.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -128.45 -178.37 4.54 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.589 1.556 . . . . 10.0 110.235 174.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.9 t -99.35 -32.79 10.99 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.333 0.515 . . . . 10.0 112.11 169.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.42 -53.48 57.07 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.585 -1.322 . . . . 10.0 114.306 -171.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -79.74 -21.86 43.98 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.622 0.725 . . . . 10.0 110.837 -178.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.404 ' CZ3' ' HG2' ' A' ' 78' ' ' LYS . 71.9 m95 -79.64 -29.28 40.95 Favored 'General case' 0 CA--C 1.554 1.114 0 O-C-N 121.348 -0.845 . . . . 10.0 112.259 174.511 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -47.12 -61.41 2.85 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.641 1.576 . . . . 10.0 114.955 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -62.91 -16.39 53.61 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.186 1.924 . . . . 10.0 112.914 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.6 mmt85 -82.92 -46.43 12.97 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.766 1.226 . . . . 10.0 108.34 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.11 -17.9 62.83 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.381 1.872 . . . . 10.0 112.518 172.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.18 -33.15 26.26 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.452 1.101 . . . . 10.0 109.666 177.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -74.84 -51.62 13.5 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 122.236 0.215 . . . . 10.0 111.075 171.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 156.21 -104.52 0.25 Allowed Glycine 0 CA--C 1.531 1.082 0 C-N-CA 123.088 0.375 . . . . 10.0 112.626 170.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.54 -61.62 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 123.98 0.912 . . . . 10.0 110.439 175.672 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.71 36.44 0.16 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.333 1.453 . . . . 10.0 113.096 -170.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -111.99 -54.1 2.64 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.786 -1.931 . . . . 10.0 105.786 -176.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -79.56 -33.71 41.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.201 1.0 . . . . 10.0 111.618 -177.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -64.02 -11.21 9.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.65 -0.656 . . . . 10.0 111.8 170.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.6 mmpt? -78.78 -45.3 21.3 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.017 -1.052 . . . . 10.0 111.383 163.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 33.9 m -63.9 -38.27 90.45 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 120.294 -1.504 . . . . 10.0 110.766 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -56.57 -39.45 62.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 121.424 0.631 . . . . 10.0 111.968 177.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.39 -29.66 53.25 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.003 0.521 . . . . 10.0 111.776 -179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 99.2 m -73.11 -32.12 64.74 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.447 0.699 . . . . 10.0 112.623 175.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.12 111.54 0.92 Allowed Glycine 0 C--N 1.34 0.778 0 N-CA-C 110.327 -1.109 . . . . 10.0 110.327 -170.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.44 -163.18 0.09 Allowed 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.685 1.194 . . . . 10.0 109.278 162.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -74.12 -67.42 0.61 Allowed 'General case' 0 N--CA 1.476 0.826 0 O-C-N 119.888 -1.758 . . . . 10.0 112.492 -170.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.38 -33.9 77.04 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.217 1.007 . . . . 10.0 111.166 173.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -73.03 128.96 87.07 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 126.4 1.88 . . . . 10.0 112.086 -172.166 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.16 144.23 68.18 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 121.632 1.555 . . . . 10.0 110.135 177.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -61.27 126.38 19.23 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.551 2.167 . . . . 10.0 109.439 175.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.06 25.53 19.31 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 120.987 -0.625 . . . . 10.0 112.939 179.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.83 35.11 4.23 Favored Glycine 0 CA--C 1.543 1.837 0 CA-C-N 118.002 0.901 . . . . 10.0 114.507 -177.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 14.3 ttm 70.13 -4.04 1.64 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.247 2.219 . . . . 10.0 114.926 -176.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.51 -38.88 6.61 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.064 -1.023 . . . . 10.0 112.511 -179.096 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 72.9 m 67.38 -60.65 0.37 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.517 1.927 . . . . 10.0 112.86 -176.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -79.64 57.05 2.37 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.724 1.21 . . . . 10.0 110.351 -177.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -112.15 123.0 49.31 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.154 1.382 . . . . 10.0 110.655 -171.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.4 t -93.57 133.31 37.01 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 173.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -32.37 -41.73 0.06 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.893 2.077 . . . . 10.0 113.326 171.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -40.61 -61.29 0.96 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.692 1.197 . . . . 10.0 113.7 170.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.12 -28.3 24.09 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.674 0.67 . . . . 10.0 111.383 178.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -43.7 78.31 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.948 -1.095 . . . . 10.0 111.244 176.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.7 ptmm? -72.49 -45.16 60.77 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.513 1.125 . . . . 10.0 109.698 178.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.25 -38.03 38.72 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 121.798 0.809 . . . . 10.0 111.889 173.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.29 -41.78 76.34 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.912 0.885 . . . . 10.0 111.851 -176.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 27.3 pt -76.24 -42.28 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 O-C-N 121.751 -0.593 . . . . 10.0 111.761 175.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . 0.258 5.7 pt-20 -64.67 -25.09 67.8 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.659 -0.651 . . . . 10.0 111.905 177.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -49.33 -44.43 44.48 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.587 0.63 . . . . 10.0 112.112 164.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 70.0 mtm -82.0 -57.26 3.49 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.464 0.705 . . . . 10.0 110.332 178.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.1 t -177.65 121.21 0.11 Allowed 'General case' 0 C--O 1.223 -0.31 0 C-N-CA 126.822 2.049 . . . . 10.0 108.207 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.57 83.1 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.001 -1.062 . . . . 10.0 112.984 178.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -157.76 -69.58 0.09 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 114.055 1.131 . . . . 10.0 114.055 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.404 ' HG2' ' CZ3' ' A' ' 31' ' ' TRP . 4.7 ptpp? . . . . . 0 C--O 1.249 1.072 0 C-N-CA 124.198 0.999 . . . . 10.0 112.103 -177.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.562 0 N-CA-C 113.134 0.79 . . . . 10.0 113.134 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.418 ' CG ' ' H ' ' A' ' 3' ' ' ALA . 15.1 t70 -138.18 -172.46 3.28 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.35 2.26 . . . . 10.0 106.399 179.213 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.418 ' H ' ' CG ' ' A' ' 2' ' ' ASP . . . -89.56 -45.65 9.23 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.653 2.381 . . . . 10.0 111.562 174.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -55.02 -50.09 69.9 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-O 121.931 0.872 . . . . 10.0 110.43 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.82 -31.44 69.33 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.464 -177.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -66.72 -52.06 49.45 Favored 'Isoleucine or valine' 0 C--N 1.34 0.18 0 N-CA-C 108.273 -1.01 . . . . 10.0 108.273 176.081 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -41.49 75.99 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 119.461 1.028 . . . . 10.0 110.328 -174.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -69.14 -23.97 64.03 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.464 1.106 . . . . 10.0 112.254 -178.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.7 ttpp -86.16 -30.48 22.45 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.18 -0.95 . . . . 10.0 113.423 166.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.38 -69.5 0.86 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.226 1.011 . . . . 10.0 112.84 -164.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.39 31.9 0.09 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.876 1.67 . . . . 10.0 111.234 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.9 t -111.38 8.71 21.38 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 124.624 1.17 . . . . 10.0 113.268 -164.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.7 t -111.42 -45.88 5.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.772 1.229 . . . . 10.0 108.902 -173.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.7 m -92.44 -64.24 1.13 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.946 1.699 . . . . 10.0 111.423 176.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -73.08 -25.65 60.97 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.425 0.69 . . . . 10.0 112.426 -166.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.03 -53.43 55.93 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.648 1.179 . . . . 10.0 111.014 -179.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.6 ttt -105.43 -21.03 13.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.283 1.033 . . . . 10.0 112.047 -178.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.95 53.48 2.37 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.111 0.862 . . . . 10.0 112.095 -175.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.8 t -95.05 162.66 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 125.131 1.372 . . . . 10.0 109.299 177.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 60.01 16.37 5.8 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.657 1.183 . . . . 10.0 113.976 -177.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.5 22.12 79.13 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 123.524 0.583 . . . . 10.0 113.028 -171.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.95 157.07 77.84 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 124.104 0.962 . . . . 10.0 112.07 177.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -72.79 165.27 33.23 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 122.577 2.185 . . . . 10.0 110.606 -178.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.9 tptt -77.37 126.42 30.88 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.652 -175.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.7 t -34.02 -42.69 0.13 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.391 2.276 . . . . 10.0 114.573 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.0 p-80 -138.59 133.51 32.6 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 108.459 -0.941 . . . . 10.0 108.459 157.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -148.59 168.43 22.79 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 125.565 1.546 . . . . 10.0 108.75 170.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.3 t -104.75 -36.83 7.29 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 120.567 -0.453 . . . . 10.0 111.438 164.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.57 -23.47 42.73 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 119.959 -1.713 . . . . 10.0 114.025 -174.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -82.68 -34.58 27.32 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.092 1.357 . . . . 10.0 109.33 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.45 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 45.9 m95 -85.82 -34.44 21.08 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 125.899 1.68 . . . . 10.0 111.907 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -43.63 -57.27 5.91 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 125.227 1.411 . . . . 10.0 114.43 174.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -65.25 -5.67 11.63 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.648 2.232 . . . . 10.0 113.898 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 8.8 mmt180 -103.05 -46.99 4.48 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.863 1.265 . . . . 10.0 110.369 179.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.2 mt -55.06 -4.3 0.07 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.883 1.673 . . . . 10.0 114.405 166.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.67 -33.31 17.62 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.087 1.355 . . . . 10.0 110.193 -176.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.53 -54.36 6.23 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 171.341 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.418 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 166.58 -132.89 2.75 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 110.916 -0.874 . . . . 10.0 110.916 -177.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 62.5 t -140.39 -56.92 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 124.181 0.992 . . . . 10.0 110.476 -173.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -69.88 11.19 0.31 Allowed 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 113.701 1.0 . . . . 10.0 113.701 -176.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.418 HD22 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -92.68 -21.67 19.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 127.516 2.327 . . . . 10.0 111.143 -179.69 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.4 -32.16 8.25 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.522 0.729 . . . . 10.0 110.874 -177.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.8 p -60.31 -23.79 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 125.68 1.592 . . . . 10.0 111.281 169.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.53 -44.66 57.08 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 121.363 -0.835 . . . . 10.0 111.875 167.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.05 -23.87 55.12 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 120.989 -1.069 . . . . 10.0 111.901 -174.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . 0.435 HG12 ' CZ ' ' A' ' 67' ' ' TYR . 1.7 p -68.95 -40.64 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 O-C-N 121.027 -1.045 . . . . 10.0 111.129 172.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.64 -31.0 66.38 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.149 0.5 . . . . 10.0 111.372 -178.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.5 t -89.43 -22.39 22.54 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.0 1.32 . . . . 10.0 112.495 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.05 117.56 0.82 Allowed Glycine 0 CA--C 1.535 1.307 0 N-CA-C 111.355 -0.698 . . . . 10.0 111.355 -170.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 tp -74.42 -152.48 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.992 0 O-C-N 122.031 -0.687 . . . . 10.0 110.393 169.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -65.27 -63.9 0.99 Allowed 'General case' 0 N--CA 1.471 0.618 0 O-C-N 119.753 -1.842 . . . . 10.0 111.592 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -101.39 44.19 1.02 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 113.282 -1.781 . . . . 10.0 109.084 -175.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -143.12 134.76 12.91 Favored Pre-proline 0 CA--C 1.536 0.42 0 C-N-CA 124.58 1.152 . . . . 10.0 111.606 -177.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.42 156.41 45.65 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 121.866 1.711 . . . . 10.0 110.211 176.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.67 120.52 7.64 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 122.759 2.306 . . . . 10.0 110.165 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.6 34.97 6.35 Favored Glycine 0 CA--C 1.531 1.087 0 O-C-N 122.091 -0.381 . . . . 10.0 113.242 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 57.18 -84.27 0.01 OUTLIER Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.556 1.074 . . . . 10.0 114.345 172.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -175.0 38.93 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.986 2.114 . . . . 10.0 112.376 165.322 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.45 147.77 49.08 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.751 1.221 . . . . 10.0 111.153 -175.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.8 t -71.42 -50.13 34.93 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -173.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -123.81 76.13 1.41 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.229 1.412 . . . . 10.0 108.473 175.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 8.3 m -71.87 91.1 1.15 Allowed 'General case' 0 CA--C 1.538 0.5 0 O-C-N 120.889 -1.132 . . . . 10.0 111.19 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -78.51 149.39 33.14 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 121.151 -0.968 . . . . 10.0 108.495 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.79 -37.32 76.07 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 120.315 1.416 . . . . 10.0 112.084 172.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.2 pt-20 -51.49 -46.6 63.22 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 119.065 -0.493 . . . . 10.0 111.608 174.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 -82.85 -39.43 21.64 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.829 0.74 . . . . 10.0 112.624 176.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . 0.435 ' CZ ' HG12 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -55.99 -46.22 78.78 Favored 'General case' 0 N--CA 1.463 0.22 0 O-C-N 120.5 -1.375 . . . . 10.0 111.543 -178.226 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -68.5 -45.79 71.39 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 -177.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.66 -38.97 61.37 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 121.633 0.73 . . . . 10.0 112.647 169.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.05 -39.55 29.56 Favored 'General case' 0 C--O 1.225 -0.226 0 O-C-N 120.602 -1.311 . . . . 10.0 113.592 -174.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.0 mt -70.38 -38.18 73.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 O-C-N 121.831 -0.543 . . . . 10.0 110.466 171.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . 0.299 0.0 OUTLIER -69.59 -31.71 70.02 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 114.195 1.183 . . . . 10.0 114.195 176.629 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -42.02 -47.14 4.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.628 1.171 . . . . 10.0 112.17 173.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.45 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.2 mpp? -81.65 -73.14 0.4 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.505 0.558 . . . . 10.0 112.505 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.2 33.87 0.17 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.155 0.582 . . . . 10.0 112.063 178.59 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.269 16.0 ptpt 42.62 46.81 4.4 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.892 1.677 . . . . 10.0 114.137 -179.297 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -150.97 -92.71 0.06 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.965 1.469 . . . . 10.0 114.965 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.4 pttt . . . . . 0 C--O 1.253 1.25 0 N-CA-C 116.071 1.878 . . . . 10.0 116.071 -175.666 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.533 0.327 0 N-CA-C 113.817 1.043 . . . . 10.0 113.817 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.437 ' CG ' ' H ' ' A' ' 3' ' ' ALA . 16.8 t70 -139.69 -137.44 0.12 Allowed 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.365 1.066 . . . . 10.0 110.366 -172.162 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.437 ' H ' ' CG ' ' A' ' 2' ' ' ASP . . . -147.94 -49.45 0.17 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 130.344 3.457 . . . . 10.0 109.302 -174.61 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -54.26 -50.51 67.07 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 121.247 0.546 . . . . 10.0 110.301 171.103 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 -29.75 68.69 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 121.777 -0.577 . . . . 10.0 111.415 -176.363 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.5 mp -68.8 -52.67 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.932 -1.136 . . . . 10.0 107.932 178.004 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.23 -41.25 81.53 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 118.225 -1.39 . . . . 10.0 110.918 -179.612 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -68.51 -22.95 64.5 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.132 1.373 . . . . 10.0 112.546 -176.779 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.72 -29.74 16.66 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.37 1.248 . . . . 10.0 114.37 166.298 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.27 -66.19 1.09 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.104 0.865 . . . . 10.0 112.363 -167.121 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.2 42.84 0.27 Allowed 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 124.126 0.971 . . . . 10.0 109.883 177.604 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.7 t -122.56 -6.88 8.64 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 120.477 -1.389 . . . . 10.0 114.03 -164.056 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.8 m -105.88 -41.97 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 123.59 0.756 . . . . 10.0 109.352 -178.219 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 m -86.88 -63.91 1.23 Allowed 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.657 1.583 . . . . 10.0 110.136 177.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -74.1 -28.23 61.26 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.277 1.214 . . . . 10.0 114.277 -167.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.1 t -59.58 -51.36 70.15 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.565 0.746 . . . . 10.0 111.408 -179.049 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 28.9 mmt -101.76 -19.49 15.33 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.434 0.694 . . . . 10.0 111.844 -179.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.18 49.59 4.17 Favored Glycine 0 CA--C 1.532 1.143 0 O-C-N 121.428 -0.795 . . . . 10.0 111.986 -178.222 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 66.6 t -99.29 162.95 2.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 126.127 1.771 . . . . 10.0 109.313 -177.816 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.68 19.66 8.34 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.411 1.084 . . . . 10.0 113.367 -176.237 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 81.23 10.29 84.94 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 124.522 1.058 . . . . 10.0 113.142 -174.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.96 144.49 95.77 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-N 118.422 1.111 . . . . 10.0 112.767 -176.863 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -81.14 151.77 18.25 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 124.784 3.656 . . . . 10.0 110.392 179.349 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.2 mptt -103.25 143.2 32.96 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.211 -166.308 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.3 p -77.05 55.23 1.11 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.207 1.003 . . . . 10.0 112.46 175.131 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -146.96 -45.59 0.18 Allowed 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 114.072 1.138 . . . . 10.0 114.072 175.939 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -71.25 149.2 46.45 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 108.369 -0.974 . . . . 10.0 108.369 -177.925 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 9.5 t -95.46 -30.5 13.83 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 118.652 0.66 . . . . 10.0 110.139 178.111 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.42 -29.08 69.72 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 114.65 1.352 . . . . 10.0 114.65 -178.234 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -76.42 -31.39 57.88 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 122.34 1.067 . . . . 10.0 111.075 176.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 73.4 m95 -89.47 -32.02 17.41 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.32 1.448 . . . . 10.0 112.355 -177.038 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -49.18 -57.45 11.57 Favored Pre-proline 0 CA--C 1.542 0.667 0 O-C-N 120.461 -1.4 . . . . 10.0 114.609 175.509 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -65.72 -1.33 4.8 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 122.609 2.206 . . . . 10.0 113.209 178.617 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.5 mmt85 -101.14 -55.16 2.62 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.987 1.315 . . . . 10.0 108.513 176.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.07 -13.73 13.15 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.725 1.61 . . . . 10.0 114.472 175.827 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -86.11 -38.84 17.34 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 124.363 1.065 . . . . 10.0 109.422 -174.135 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.49 -45.56 37.63 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.549 -0.75 . . . . 10.0 110.932 174.594 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 161.92 -136.32 4.32 Favored Glycine 0 CA--C 1.533 1.158 0 N-CA-C 110.822 -0.911 . . . . 10.0 110.822 -178.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 67.0 t -139.61 -57.53 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 122.524 1.154 . . . . 10.0 111.048 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -43.33 -36.78 1.99 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.281 1.832 . . . . 10.0 112.988 170.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -47.21 -27.32 1.45 Allowed 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.822 1.045 . . . . 10.0 113.822 173.883 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -100.45 -38.48 8.39 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 125.206 1.402 . . . . 10.0 111.471 179.535 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -53.26 -36.81 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 CA-C-N 118.912 0.778 . . . . 10.0 110.285 170.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.9 ptmt -63.72 -44.24 94.17 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.145 1.165 . . . . 10.0 114.145 171.446 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.7 m -64.46 -33.96 77.1 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 120.91 -1.119 . . . . 10.0 110.241 178.669 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.6 t -62.42 -55.0 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 123.736 0.814 . . . . 10.0 112.072 176.328 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.82 -36.97 65.56 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.762 0.315 . . . . 10.0 111.617 177.28 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 21.7 m -71.13 -34.67 71.26 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.945 0.898 . . . . 10.0 111.79 -177.802 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 75.4 112.32 0.1 Allowed Glycine 0 C--N 1.339 0.701 0 N-CA-C 110.596 -1.002 . . . . 10.0 110.596 -167.951 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.0 tp -68.9 -170.48 0.23 Allowed 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 121.501 0.667 . . . . 10.0 109.708 167.232 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -68.09 -61.01 2.05 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 119.559 -1.963 . . . . 10.0 112.023 -167.323 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.97 -40.85 83.07 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.789 1.236 . . . . 10.0 112.041 172.154 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.8 ttt -74.45 120.85 83.47 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 126.572 1.949 . . . . 10.0 112.594 -174.005 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -63.5 156.9 53.92 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.264 1.976 . . . . 10.0 111.712 -177.558 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -57.87 141.85 96.09 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 123.296 2.664 . . . . 10.0 110.475 178.143 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.23 22.01 72.42 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 120.177 -1.011 . . . . 10.0 113.451 -175.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.96 29.48 4.53 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 124.435 1.017 . . . . 10.0 114.462 -176.422 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.9 ttt 75.01 23.87 1.59 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.115 1.766 . . . . 10.0 114.382 -178.057 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.5 t -95.26 155.9 16.54 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 121.107 -0.995 . . . . 10.0 113.228 -179.086 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 41.4 m -69.75 -82.22 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.125 0.97 . . . . 10.0 112.552 178.627 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -125.49 43.12 3.13 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.421 1.088 . . . . 10.0 110.61 -176.711 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.27 126.96 29.74 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.224 -0.922 . . . . 10.0 111.658 -179.174 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.5 m -97.66 -83.49 0.4 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.544 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -156.08 -53.75 0.08 Allowed 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 127.278 2.231 . . . . 10.0 110.162 179.9 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -51.93 -42.53 62.87 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.08 0.552 . . . . 10.0 111.413 178.018 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -47.43 45.84 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 106.977 -1.49 . . . . 10.0 106.977 -178.045 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.24 -52.7 63.68 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.789 1.636 . . . . 10.0 111.798 -173.545 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -66.92 -42.31 85.58 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 125.055 1.342 . . . . 10.0 109.083 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.6 -35.46 63.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.448 1.022 . . . . 10.0 112.772 170.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.9 -47.01 49.49 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 120.293 -1.504 . . . . 10.0 111.099 177.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.1 mt -63.61 -37.61 80.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.982 1.313 . . . . 10.0 112.309 177.148 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -71.42 -30.33 65.94 Favored 'General case' 0 C--O 1.231 0.088 0 C-N-CA 124.606 1.162 . . . . 10.0 111.152 176.411 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -53.44 -30.09 38.76 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 112.927 0.714 . . . . 10.0 112.927 171.288 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 71.0 mtm -90.09 -72.72 0.55 Allowed 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.628 -0.67 . . . . 10.0 112.629 178.692 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.49 37.73 0.24 Allowed 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.765 -0.584 . . . . 10.0 112.497 176.24 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.7 ptmt 40.66 56.5 2.79 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 126.057 1.743 . . . . 10.0 114.665 172.489 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -159.72 -78.35 0.06 Allowed 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 124.371 1.068 . . . . 10.0 111.357 170.211 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.242 0.666 0 N-CA-C 113.003 0.742 . . . . 10.0 113.003 -176.602 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 . . . . . 0 CA--C 1.53 0.181 0 N-CA-C 114.848 1.425 . . . . 10.0 114.848 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -156.52 120.49 4.37 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.613 0.721 . . . . 10.0 109.605 179.85 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -43.97 -39.14 3.87 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 114.741 1.386 . . . . 10.0 114.741 170.158 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -56.62 -47.95 78.53 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 121.874 -0.516 . . . . 10.0 110.51 172.365 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.23 -33.09 73.76 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.837 -0.539 . . . . 10.0 110.87 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 12.8 mm -65.17 -52.07 57.62 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 176.147 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.57 -41.78 79.23 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 118.144 -1.422 . . . . 10.0 111.438 -178.244 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -68.79 -22.64 64.26 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.08 1.352 . . . . 10.0 112.473 -176.756 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -94.42 -28.41 15.52 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.081 1.141 . . . . 10.0 114.081 168.676 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.23 -63.84 1.25 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.14 0.976 . . . . 10.0 113.005 -171.749 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.4 35.6 0.15 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.198 1.399 . . . . 10.0 111.04 -178.303 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.4 t -124.94 -1.57 7.81 Favored 'General case' 0 N--CA 1.46 0.054 0 C-N-CA 124.97 1.308 . . . . 10.0 113.779 -163.74 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.2 t -104.56 -47.83 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 124.783 1.233 . . . . 10.0 108.957 -173.016 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.5 m -84.33 -65.53 1.0 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.186 1.395 . . . . 10.0 110.717 172.05 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -74.4 -20.81 59.92 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.169 1.544 . . . . 10.0 115.169 -163.004 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m -64.73 -44.64 89.5 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 118.392 0.542 . . . . 10.0 110.979 176.845 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.8 mmt -102.17 -22.88 14.11 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.819 1.247 . . . . 10.0 111.899 -177.057 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.13 41.7 6.96 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.094 0.854 . . . . 10.0 111.931 -175.169 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 84.7 t -87.6 159.81 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 124.459 1.104 . . . . 10.0 109.417 179.076 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.63 16.17 5.21 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.938 1.295 . . . . 10.0 113.571 -174.342 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.92 16.18 80.24 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.212 0.91 . . . . 10.0 113.361 -172.803 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.78 132.79 94.0 Favored Pre-proline 0 CA--C 1.544 0.721 0 CA-C-N 118.649 1.224 . . . . 10.0 113.339 -174.55 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.11 140.85 61.25 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.788 2.992 . . . . 10.0 111.206 -178.589 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.36 145.21 55.97 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.809 0.814 . . . . 10.0 112.353 -166.712 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.9 p -51.34 -37.64 48.91 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.39 1.076 . . . . 10.0 113.275 176.455 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -122.19 40.88 3.54 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.398 1.258 . . . . 10.0 114.398 -174.598 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -85.03 165.35 17.61 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.425 -0.797 . . . . 10.0 112.099 174.103 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.2 t -104.34 -34.94 8.13 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.427 0.291 . . . . 10.0 111.415 165.663 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.43 -33.64 60.94 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 120.787 -1.195 . . . . 10.0 113.035 -174.689 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -73.15 -28.9 62.5 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.105 0.479 . . . . 10.0 110.366 179.305 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 69.7 m95 -91.67 -35.46 14.18 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.764 2.026 . . . . 10.0 110.938 -174.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -40.28 -63.17 0.76 Allowed Pre-proline 0 CA--C 1.547 0.832 0 N-CA-C 115.038 1.496 . . . . 10.0 115.038 174.173 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -66.19 -6.12 13.98 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.867 2.378 . . . . 10.0 113.497 -178.664 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.5 mmt85 -98.98 -45.63 5.89 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.977 1.711 . . . . 10.0 108.994 -177.916 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -24.39 63.51 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.818 2.047 . . . . 10.0 110.702 177.556 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.47 -28.53 52.36 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.366 1.066 . . . . 10.0 109.747 176.378 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt -77.38 -52.5 9.04 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.5 0.32 . . . . 10.0 110.519 172.654 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.436 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 164.63 -106.8 0.28 Allowed Glycine 0 CA--C 1.531 1.061 0 C-N-CA 123.558 0.599 . . . . 10.0 111.75 172.823 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.445 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -153.83 -61.58 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 C-N-CA 123.971 0.908 . . . . 10.0 109.413 177.405 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.6 24.52 0.06 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.035 1.334 . . . . 10.0 113.242 -171.53 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.445 ' H ' ' C ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -106.57 -25.64 11.73 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 127.705 2.402 . . . . 10.0 108.822 -176.767 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -99.52 -42.48 6.91 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.892 1.277 . . . . 10.0 110.85 178.948 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 p -53.25 -35.74 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 122.884 0.474 . . . . 10.0 111.069 171.985 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 ptmt -59.93 -43.6 94.85 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.717 -1.239 . . . . 10.0 112.419 171.767 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.7 m -72.46 -33.78 67.27 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.692 -0.63 . . . . 10.0 110.72 -176.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -47.57 85.62 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 O-C-N 122.067 -0.396 . . . . 10.0 111.197 172.617 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -30.8 71.11 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.788 0.328 . . . . 10.0 111.725 177.005 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.89 -35.95 64.72 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.535 0.939 . . . . 10.0 113.535 179.386 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.47 109.25 0.53 Allowed Glycine 0 CA--C 1.529 0.947 0 N-CA-C 111.254 -0.738 . . . . 10.0 111.254 -167.175 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.71 -154.79 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.139 0.975 . . . . 10.0 109.147 168.959 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -73.04 -66.53 0.66 Allowed 'General case' 0 N--CA 1.479 0.978 0 O-C-N 119.231 -2.168 . . . . 10.0 111.557 -174.875 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.35 -21.48 61.3 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.329 1.052 . . . . 10.0 111.801 174.396 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.4 mtm -84.87 125.2 71.44 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 112.525 0.565 . . . . 10.0 112.525 -179.668 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.51 150.09 69.27 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.063 1.842 . . . . 10.0 111.194 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -60.8 115.07 2.44 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 123.342 2.695 . . . . 10.0 109.817 179.669 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 95.5 10.78 56.56 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 121.309 -0.472 . . . . 10.0 113.559 -175.479 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.98 53.49 7.42 Favored Glycine 0 CA--C 1.536 1.391 0 CA-C-N 118.508 1.154 . . . . 10.0 113.233 175.156 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 83.02 -41.02 0.1 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 127.012 2.125 . . . . 10.0 112.588 -176.797 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.0 t -78.88 176.46 9.57 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.677 -0.64 . . . . 10.0 110.857 174.437 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.0 p -125.17 -73.59 0.63 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.912 1.285 . . . . 10.0 108.282 167.644 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -79.02 58.99 2.56 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.632 1.973 . . . . 10.0 110.439 -179.112 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 25.6 m -109.4 143.82 38.44 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.196 0.998 . . . . 10.0 112.729 169.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 98.8 m -125.83 151.09 47.28 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 125.389 1.476 . . . . 10.0 109.922 -178.781 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -39.59 -38.41 0.6 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.7 2.0 . . . . 10.0 114.82 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -35.33 -53.24 0.64 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.867 1.267 . . . . 10.0 114.349 168.362 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -99.63 -26.51 14.06 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.515 1.526 . . . . 10.0 113.274 171.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -50.38 40.9 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.391 -1.443 . . . . 10.0 110.665 -176.187 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.9 tttt -67.58 -50.71 57.04 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 123.794 0.838 . . . . 10.0 108.909 179.606 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.11 -26.08 2.51 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.512 0.93 . . . . 10.0 113.512 173.413 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.69 -39.38 20.24 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.893 1.277 . . . . 10.0 110.676 -179.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 3.5 mt -72.85 -45.99 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 125.456 1.502 . . . . 10.0 111.789 177.651 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.84 -26.61 67.74 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.434 1.094 . . . . 10.0 112.73 177.229 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -53.43 -28.54 30.57 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.399 0.889 . . . . 10.0 113.399 169.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 62.7 mtm -87.59 -78.05 0.32 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.69 0.796 . . . . 10.0 112.104 179.676 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.4 t -153.37 37.61 0.48 Allowed 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.823 -0.548 . . . . 10.0 111.588 176.255 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt 32.78 66.14 0.21 Allowed 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.532 1.933 . . . . 10.0 114.915 174.669 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.09 -53.86 0.06 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.419 0.896 . . . . 10.0 113.419 -176.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.506 ' NZ ' ' OXT' ' A' ' 78' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.604 0 C-N-CA 126.15 1.78 . . . . 10.0 111.344 -179.704 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 . . . . . 0 CA--C 1.534 0.337 0 N-CA-C 113.625 0.972 . . . . 10.0 113.625 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -142.98 128.78 19.37 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.112 -1.07 . . . . 10.0 108.112 171.754 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -52.87 -38.31 61.45 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.44 1.096 . . . . 10.0 112.983 172.128 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -56.61 -48.7 76.9 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.781 0.324 . . . . 10.0 110.275 170.206 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.91 -32.22 70.42 Favored 'General case' 0 CA--C 1.528 0.103 0 O-C-N 121.696 -0.627 . . . . 10.0 111.72 -177.611 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 36.0 mt -64.76 -52.96 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 N-CA-C 107.328 -1.36 . . . . 10.0 107.328 176.252 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.417 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -69.38 -42.52 75.06 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 117.934 -1.506 . . . . 10.0 111.457 -176.298 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -70.49 -24.03 62.78 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.689 1.595 . . . . 10.0 113.148 -176.618 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.14 -31.29 19.24 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.12 0.873 . . . . 10.0 111.984 167.604 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.408 ' C ' ' H ' ' A' ' 12' ' ' THR . . . -102.4 -68.23 0.84 Allowed 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 114.094 1.146 . . . . 10.0 114.094 -171.773 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.417 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.82 41.12 0.34 Allowed 'General case' 0 CA--C 1.554 1.107 0 CA-C-O 123.176 1.465 . . . . 10.0 109.238 -174.922 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.408 ' H ' ' C ' ' A' ' 10' ' ' ALA . 7.0 t -123.99 -10.23 7.67 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 126.34 1.856 . . . . 10.0 112.701 -164.644 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 49.2 t -92.97 -51.62 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 C-N-CA 125.401 1.48 . . . . 10.0 108.102 -177.215 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.7 m -95.14 -57.12 2.51 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.701 1.601 . . . . 10.0 109.816 -171.771 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -73.15 -23.98 60.53 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.001 0.92 . . . . 10.0 112.914 -169.789 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.7 t -62.46 -40.43 96.61 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.799 0.809 . . . . 10.0 111.332 -173.802 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.3 tpt -118.77 -32.49 4.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.564 1.545 . . . . 10.0 112.337 -178.198 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.82 58.9 1.55 Allowed Glycine 0 CA--C 1.534 1.252 0 C-N-CA 124.704 1.145 . . . . 10.0 113.343 -176.687 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 96.0 t -82.35 -57.44 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 O-C-N 121.637 -0.92 . . . . 10.0 112.625 -176.581 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.05 31.22 0.38 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.035 0.934 . . . . 10.0 111.113 179.78 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 62.28 25.78 67.03 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 123.763 0.696 . . . . 10.0 112.552 -169.781 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.78 148.22 96.47 Favored Pre-proline 0 CA--C 1.54 0.578 0 O-C-N 122.015 -0.697 . . . . 10.0 111.467 177.079 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -77.62 142.4 20.51 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 123.287 2.658 . . . . 10.0 111.709 -171.15 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.39 130.18 30.58 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.347 1.24 . . . . 10.0 114.347 -172.295 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.0 m -17.33 -74.04 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 128.922 2.889 . . . . 10.0 115.627 -177.843 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -146.16 115.18 6.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 169.499 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -143.79 -175.74 4.7 Favored 'General case' 0 N--CA 1.443 -0.79 0 C-N-CA 124.325 1.05 . . . . 10.0 110.182 176.532 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 t -102.96 -30.0 11.06 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 170.014 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.47 -52.56 64.69 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 119.892 -1.755 . . . . 10.0 114.452 -173.98 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.429 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 9.5 t0 -77.8 -22.07 50.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.319 1.848 . . . . 10.0 110.049 -179.777 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 54.3 m95 -86.74 -25.44 24.7 Favored 'General case' 0 CA--C 1.553 1.088 0 O-C-N 121.134 -0.979 . . . . 10.0 112.485 177.83 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -49.47 -56.91 13.75 Favored Pre-proline 0 CA--C 1.54 0.586 0 O-C-N 120.543 -1.348 . . . . 10.0 113.096 174.874 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -69.7 9.75 0.55 Allowed 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 122.457 2.104 . . . . 10.0 113.612 178.322 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -110.31 -49.97 3.01 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.477 1.511 . . . . 10.0 108.687 173.784 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 16.8 mt -63.43 9.01 0.06 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.51 1.924 . . . . 10.0 114.65 171.043 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -95.93 -29.16 14.32 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.406 1.482 . . . . 10.0 110.6 175.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.9 mmtt -92.47 -54.13 3.92 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.143 0.977 . . . . 10.0 109.968 179.844 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 166.72 -139.69 5.89 Favored Glycine 0 CA--C 1.533 1.167 0 N-CA-C 110.725 -0.95 . . . . 10.0 110.725 -178.543 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 60.5 t -132.75 -63.15 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.418 1.087 . . . . 10.0 109.545 -175.504 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.66 10.15 0.11 Allowed 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 125.98 1.712 . . . . 10.0 114.025 -176.447 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -90.63 -19.55 23.54 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 128.455 2.702 . . . . 10.0 111.48 176.743 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mt -106.48 -41.19 5.35 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.627 1.171 . . . . 10.0 109.028 -171.381 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.5 p -51.53 -37.0 18.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 C-N-CA 123.049 0.54 . . . . 10.0 111.556 168.227 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.3 ptmt -62.79 -39.22 93.56 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.022 -1.049 . . . . 10.0 113.285 171.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.9 m -70.3 -37.65 74.84 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 121.039 -1.038 . . . . 10.0 110.656 -179.67 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 14.2 t -52.88 -53.63 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 124.043 0.937 . . . . 10.0 110.395 172.209 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -35.75 74.09 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.774 0.657 . . . . 10.0 112.774 176.629 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 63.2 m -72.19 -33.3 67.55 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 118.9 -0.571 . . . . 10.0 112.319 -179.378 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.86 85.1 0.5 Allowed Glycine 0 CA--C 1.533 1.17 0 CA-C-N 119.413 1.006 . . . . 10.0 111.215 -174.019 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.44 172.38 0.34 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.655 1.182 . . . . 10.0 111.523 170.307 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -46.85 -57.79 4.57 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.802 -1.186 . . . . 10.0 112.992 -170.767 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -102.13 28.26 5.97 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 113.647 -1.615 . . . . 10.0 110.585 -179.644 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.3 mmm -123.07 129.2 25.05 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.912 1.285 . . . . 10.0 112.484 179.553 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -68.87 157.34 62.23 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.739 2.293 . . . . 10.0 110.825 176.098 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -61.85 132.81 41.52 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.508 2.139 . . . . 10.0 109.31 -178.679 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 53.45 41.12 63.0 Favored Glycine 0 C--N 1.338 0.673 0 C-N-CA 121.504 -0.379 . . . . 10.0 112.929 -178.185 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.47 50.58 10.34 Favored Glycine 0 CA--C 1.532 1.121 0 N-CA-C 112.062 -0.415 . . . . 10.0 112.062 -179.514 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 65.05 36.72 7.19 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.762 1.625 . . . . 10.0 112.808 176.592 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.5 t -126.18 148.74 49.37 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.293 1.037 . . . . 10.0 111.543 175.319 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 25.4 m -81.54 -75.03 0.3 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.259 0.623 . . . . 10.0 111.048 179.407 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -114.27 41.8 2.21 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.879 1.272 . . . . 10.0 111.631 -175.348 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 7.1 m -61.43 136.57 58.08 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.152 -0.968 . . . . 10.0 110.833 171.248 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 28.6 m -107.13 159.04 16.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.985 1.714 . . . . 10.0 108.881 175.775 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -44.26 -43.7 7.49 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.219 1.192 . . . . 10.0 114.219 175.865 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -51.56 -38.03 52.43 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.084 0.401 . . . . 10.0 112.084 176.595 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.41 -48.15 9.28 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.922 0.889 . . . . 10.0 111.131 177.039 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.11 -52.44 65.73 Favored 'General case' 0 C--N 1.34 0.157 0 O-C-N 121.338 -0.851 . . . . 10.0 111.572 -175.725 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -61.13 -53.16 60.51 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 -179.563 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.29 -37.12 10.19 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.238 0.829 . . . . 10.0 113.238 170.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.34 -43.22 77.96 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.095 -1.003 . . . . 10.0 112.373 179.901 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 21.8 pt -76.23 -35.34 27.72 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 O-C-N 121.34 -0.85 . . . . 10.0 112.729 177.254 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -67.92 -29.31 68.36 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.535 1.534 . . . . 10.0 111.843 171.56 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -54.35 -50.54 67.2 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.95 -1.093 . . . . 10.0 110.861 169.696 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 70.1 mtm -65.77 -65.09 0.72 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.595 0.358 . . . . 10.0 110.071 178.047 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.8 m -141.66 -87.4 0.16 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.055 -0.35 . . . . 10.0 110.055 175.507 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt 174.34 49.27 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.131 1.772 . . . . 10.0 110.855 -176.598 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -168.4 -83.97 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.563 1.319 . . . . 10.0 114.563 179.58 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.429 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.151 0 N-CA-C 114.457 1.28 . . . . 10.0 114.457 -170.639 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.536 0.426 0 N-CA-C 115.137 1.532 . . . . 10.0 115.137 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -161.81 167.91 24.04 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.498 1.519 . . . . 10.0 107.27 -173.553 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.38 -49.02 13.02 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.645 2.378 . . . . 10.0 112.183 172.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -58.3 -45.92 87.07 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-O 121.126 0.488 . . . . 10.0 110.599 -179.398 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.29 -34.38 77.85 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.04 -0.412 . . . . 10.0 109.962 -176.68 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.8 mm -66.45 -50.56 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 118.388 -0.815 . . . . 10.0 110.779 177.009 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.1 -39.26 86.7 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 117.011 -1.876 . . . . 10.0 111.048 179.29 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -69.17 -22.45 63.91 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.482 1.513 . . . . 10.0 113.099 -178.107 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.61 -29.13 16.3 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.138 0.975 . . . . 10.0 113.175 170.758 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.22 -64.63 1.27 Allowed 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.136 0.974 . . . . 10.0 112.667 -169.286 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.01 42.05 0.24 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.893 1.277 . . . . 10.0 110.896 177.834 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.2 t -126.65 -2.5 6.69 Favored 'General case' 0 CA--C 1.521 -0.146 0 C-N-CA 124.948 1.299 . . . . 10.0 114.067 -163.968 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.8 t -102.78 -52.52 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 124.019 0.928 . . . . 10.0 108.861 -174.256 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.3 m -81.14 -64.91 1.09 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.728 1.611 . . . . 10.0 110.471 175.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 28.8 m-70 -73.65 -13.03 60.93 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.01 1.324 . . . . 10.0 114.534 -163.936 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 t -73.51 -38.92 65.18 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.161 0.584 . . . . 10.0 110.658 -179.101 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.8 tpt -117.87 -34.32 4.22 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.899 1.279 . . . . 10.0 113.001 -177.039 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.9 52.62 2.06 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.687 1.613 . . . . 10.0 113.414 178.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . 0.405 ' C ' ' H ' ' A' ' 21' ' ' GLY . 84.4 t -75.02 -56.15 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 O-C-N 121.702 -0.881 . . . . 10.0 112.585 -174.452 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.91 33.72 0.44 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.74 0.816 . . . . 10.0 111.038 -179.299 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.405 ' H ' ' C ' ' A' ' 19' ' ' VAL . . . 65.04 21.35 67.81 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 124.406 1.003 . . . . 10.0 112.606 -170.809 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.65 140.59 97.5 Favored Pre-proline 0 CA--C 1.546 0.806 0 N-CA-C 113.426 0.899 . . . . 10.0 113.426 -172.559 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -71.56 143.4 42.38 Favored 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 125.217 3.945 . . . . 10.0 111.038 -177.255 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -67.19 145.14 55.54 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.258 -0.901 . . . . 10.0 113.43 -166.136 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 79.0 p -41.03 -40.09 1.36 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.714 1.206 . . . . 10.0 113.442 161.499 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -133.06 122.84 24.73 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.939 1.296 . . . . 10.0 110.511 171.706 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -154.69 170.46 21.5 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.867 2.067 . . . . 10.0 107.727 172.58 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.3 m -110.61 -37.99 5.3 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.644 0.656 . . . . 10.0 111.93 169.366 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.83 -19.72 37.03 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 120.996 -1.065 . . . . 10.0 112.836 -175.946 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -79.1 -35.51 42.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.455 1.902 . . . . 10.0 110.133 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.463 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 70.5 m95 -88.48 -37.87 15.44 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.802 2.441 . . . . 10.0 112.736 -179.695 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -40.01 -59.96 1.6 Allowed Pre-proline 0 CA--C 1.545 0.773 0 N-CA-C 113.983 1.105 . . . . 10.0 113.983 173.696 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.65 22.13 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.073 3.182 . . . . 10.0 114.731 178.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.98 -47.27 1.65 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.288 1.835 . . . . 10.0 109.854 167.7 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.5 mt -54.81 -5.45 0.09 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.316 1.846 . . . . 10.0 114.154 168.142 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.35 -31.41 48.56 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.194 1.398 . . . . 10.0 109.792 178.245 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.3 mttp -91.31 -57.18 2.87 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.79 0.436 . . . . 10.0 110.515 169.531 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.66 -114.52 0.66 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.255 -0.738 . . . . 10.0 111.255 172.643 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -127.04 175.74 8.45 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.085 0 C-N-CA 125.529 1.531 . . . . 10.0 110.612 176.904 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.9 t70 73.45 -42.15 0.51 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.37 1.468 . . . . 10.0 112.138 -174.381 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -20.22 8.34 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.262 -0.899 . . . . 10.0 113.192 -176.353 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -103.51 -40.65 6.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.676 1.59 . . . . 10.0 111.572 178.988 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -48.27 -35.52 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 124.622 1.169 . . . . 10.0 111.819 167.449 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -66.81 -43.48 83.69 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 120.528 -1.358 . . . . 10.0 114.065 169.115 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.5 m -72.34 -34.12 67.8 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.643 -1.286 . . . . 10.0 111.522 -176.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 9.9 p -68.03 -47.16 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 O-C-N 121.612 -0.68 . . . . 10.0 110.967 174.268 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -56.07 -41.97 75.93 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.112 0.414 . . . . 10.0 110.822 -179.904 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 32.7 p -72.86 -35.1 67.14 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.115 0.783 . . . . 10.0 113.115 178.491 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.15 105.59 0.85 Allowed Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.868 0.758 . . . . 10.0 112.562 -174.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.87 170.38 4.32 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.151 0.981 . . . . 10.0 111.621 171.053 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.407 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 5.2 m-80 -52.04 -60.36 3.28 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.583 -1.323 . . . . 10.0 113.419 -169.268 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.51 15.85 1.92 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.692 1.197 . . . . 10.0 112.635 174.167 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.9 ttp -125.39 129.72 24.35 Favored Pre-proline 0 CA--C 1.547 0.84 0 N-CA-C 113.834 1.05 . . . . 10.0 113.834 -175.128 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.16 156.75 53.42 Favored 'Trans proline' 0 CA--C 1.538 0.721 0 C-N-CA 121.492 1.461 . . . . 10.0 111.636 178.758 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -57.48 139.26 89.61 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 122.408 2.072 . . . . 10.0 109.143 177.835 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.32 23.23 59.8 Favored Glycine 0 CA--C 1.528 0.858 0 C-N-CA 121.162 -0.542 . . . . 10.0 114.025 -174.378 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 49.66 37.27 26.83 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.278 1.039 . . . . 10.0 111.266 -174.272 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER 91.55 -27.13 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.487 2.315 . . . . 10.0 112.871 -176.478 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 19.3 t -95.46 69.82 3.07 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.087 -1.008 . . . . 10.0 113.048 -176.864 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.4 m -53.82 -22.06 8.82 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.263 -0.898 . . . . 10.0 113.03 170.322 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -78.57 -24.36 45.6 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 127.005 2.122 . . . . 10.0 112.785 -178.677 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 66.4 m -70.66 144.95 50.92 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.988 -1.07 . . . . 10.0 112.938 -173.536 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 91.3 m -100.54 -91.09 0.31 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.412 0.551 . . . . 10.0 110.526 -174.394 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -152.45 -50.03 0.11 Allowed 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 124.702 1.201 . . . . 10.0 109.57 179.154 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -52.96 -57.84 8.96 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.342 -0.849 . . . . 10.0 112.844 175.625 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -74.16 -28.61 61.39 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.443 1.02 . . . . 10.0 110.23 -179.021 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.28 -53.81 38.49 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.566 1.146 . . . . 10.0 111.206 -177.327 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.0 pttp -62.67 -49.73 73.97 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 107.362 -1.347 . . . . 10.0 107.362 179.426 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.95 -34.94 57.85 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.118 0.567 . . . . 10.0 112.247 175.811 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.51 -49.82 72.02 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.644 -0.66 . . . . 10.0 110.684 177.718 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 7.0 mt -67.65 -40.83 84.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.347 0.594 . . . . 10.0 111.768 176.572 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -57.83 -37.29 73.57 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.928 1.291 . . . . 10.0 111.435 172.804 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -54.26 -44.63 71.97 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.733 0.642 . . . . 10.0 112.733 176.796 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.463 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 1.2 mpp? -69.19 -74.05 0.14 Allowed 'General case' 0 CA--C 1.541 0.613 0 O-C-N 122.095 -0.378 . . . . 10.0 111.902 179.274 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 t -161.0 37.76 0.15 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.246 0.619 . . . . 10.0 112.3 178.496 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.255 2.5 ptpt 42.51 55.36 4.17 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.554 1.942 . . . . 10.0 114.741 174.613 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -158.86 -87.4 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.505 -0.77 . . . . 10.0 112.372 178.437 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.033 0 N-CA-C 115.687 1.736 . . . . 10.0 115.687 -163.512 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.53 0.211 0 N-CA-C 112.221 0.452 . . . . 10.0 112.221 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -147.03 112.69 5.66 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 124.028 0.931 . . . . 10.0 109.072 174.746 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -38.29 -41.64 0.63 Allowed 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.274 1.583 . . . . 10.0 115.274 166.155 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -58.04 -48.29 80.55 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.121 0.873 . . . . 10.0 110.404 171.399 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.22 -33.22 74.9 Favored 'General case' 0 N--CA 1.457 -0.122 0 O-C-N 121.795 -0.566 . . . . 10.0 110.37 -178.228 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 15.9 mm -65.84 -50.79 68.06 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-O 118.46 -0.781 . . . . 10.0 109.94 174.831 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.418 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -67.58 -40.39 84.83 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 117.379 -1.729 . . . . 10.0 111.15 -178.772 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -69.4 -22.68 63.68 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.971 1.708 . . . . 10.0 112.922 -178.704 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -92.69 -29.18 16.2 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.648 1.179 . . . . 10.0 113.206 170.663 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.92 -63.78 1.36 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.443 1.097 . . . . 10.0 112.734 -170.732 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.418 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.51 40.32 0.17 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.908 1.283 . . . . 10.0 111.131 178.962 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -127.6 1.57 6.17 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 114.254 1.205 . . . . 10.0 114.254 -164.158 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.7 t -96.75 -42.38 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 C-N-CA 124.918 1.287 . . . . 10.0 108.399 -179.139 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.2 m -105.33 -58.96 1.82 Allowed 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.666 1.986 . . . . 10.0 109.506 -169.428 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -74.26 -26.21 60.08 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.88 1.067 . . . . 10.0 113.88 -172.267 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.0 m -59.55 -47.86 83.9 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.415 0.686 . . . . 10.0 111.292 -177.961 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.6 tpt -106.83 -23.74 12.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.634 0.773 . . . . 10.0 111.932 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.04 57.99 1.63 Allowed Glycine 0 CA--C 1.535 1.323 0 C-N-CA 123.866 0.746 . . . . 10.0 112.234 -173.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 51.6 t -105.62 161.02 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 125.842 1.657 . . . . 10.0 109.518 -179.836 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 55.89 26.61 9.94 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.253 1.021 . . . . 10.0 112.693 -175.163 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.8 11.09 84.83 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.622 1.106 . . . . 10.0 113.944 -176.46 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.3 142.43 92.44 Favored Pre-proline 0 CA--C 1.548 0.87 0 CA-C-N 118.926 1.363 . . . . 10.0 113.761 -173.172 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -75.13 152.13 39.78 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 125.145 3.897 . . . . 10.0 110.529 -178.416 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.78 141.94 38.57 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -165.809 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.6 p -79.07 50.26 1.02 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.351 1.461 . . . . 10.0 113.43 -179.052 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -146.72 -39.71 0.21 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 115.623 1.712 . . . . 10.0 115.623 177.361 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.88 153.94 39.65 Favored 'General case' 0 C--O 1.226 -0.163 0 N-CA-C 108.211 -1.033 . . . . 10.0 108.211 179.289 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 34.1 m -96.13 -30.17 13.67 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 119.485 1.039 . . . . 10.0 110.267 174.251 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.39 -31.28 63.7 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.787 1.403 . . . . 10.0 114.787 -178.951 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -77.1 -31.41 55.84 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-O 121.792 0.806 . . . . 10.0 111.539 178.055 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.499 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 59.9 m95 -85.99 -33.6 21.04 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.119 2.167 . . . . 10.0 112.266 -178.265 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -46.94 -56.54 11.52 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.35 1.46 . . . . 10.0 113.424 175.5 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.35 14.97 0.21 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.321 2.681 . . . . 10.0 114.016 178.351 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.32 -52.65 2.48 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.014 1.726 . . . . 10.0 109.357 167.073 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.77 -19.2 62.22 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.642 1.577 . . . . 10.0 112.588 -179.204 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.13 -35.27 25.72 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 125.064 1.345 . . . . 10.0 109.601 -178.754 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -72.4 -50.36 27.0 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.175 171.12 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.453 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 162.68 -130.21 2.21 Favored Glycine 0 CA--C 1.533 1.177 0 N-CA-C 111.237 -0.745 . . . . 10.0 111.237 177.298 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.401 ' C ' ' H ' ' A' ' 41' ' ' ASN . 3.1 t -136.29 -58.84 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 123.753 0.821 . . . . 10.0 109.442 -178.01 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.67 11.08 0.06 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.607 1.963 . . . . 10.0 114.285 -177.701 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.453 HD22 ' N ' ' A' ' 38' ' ' GLY . 0.2 OUTLIER -96.43 -20.97 18.04 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 127.104 2.161 . . . . 10.0 110.837 178.577 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -100.26 -41.56 7.03 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.108 0.563 . . . . 10.0 111.352 -178.65 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -52.89 -35.71 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 CA-C-O 121.279 0.562 . . . . 10.0 111.188 172.564 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.3 ptmt -64.77 -43.75 92.25 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.954 1.094 . . . . 10.0 113.954 170.303 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.8 -36.7 81.87 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.017 -1.052 . . . . 10.0 109.78 177.128 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 23.0 t -60.1 -57.89 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.837 0 C-N-CA 123.067 0.547 . . . . 10.0 110.385 176.139 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -55.84 -34.53 65.5 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 112.885 0.698 . . . . 10.0 112.885 177.579 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.5 m -72.05 -35.94 69.47 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 176.014 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.61 109.74 0.54 Allowed Glycine 0 CA--C 1.536 1.384 0 CA-C-N 119.324 0.966 . . . . 10.0 112.16 -173.027 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.55 -174.45 3.39 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.304 1.042 . . . . 10.0 111.412 175.322 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -51.58 -55.37 19.55 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 123.317 1.532 . . . . 10.0 112.973 -167.165 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -113.14 34.2 4.62 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 111.575 -2.557 . . . . 10.0 108.915 -176.758 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 44.9 ttp -138.46 123.75 12.2 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 177.799 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -65.91 160.79 42.41 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 122.688 2.259 . . . . 10.0 111.963 -177.739 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -59.57 127.43 23.67 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.784 2.323 . . . . 10.0 109.891 -178.654 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.64 10.58 85.81 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 114.403 0.521 . . . . 10.0 114.403 -173.16 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 62.18 30.54 76.13 Favored Glycine 0 CA--C 1.54 1.624 0 CA-C-N 119.199 1.499 . . . . 10.0 112.697 -178.761 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 80.25 55.15 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.815 2.046 . . . . 10.0 111.549 176.137 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -127.69 167.24 16.72 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.907 1.683 . . . . 10.0 110.956 178.082 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.2 m -118.02 -89.28 0.59 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.861 0.864 . . . . 10.0 110.528 176.987 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -93.2 66.31 4.03 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.444 1.098 . . . . 10.0 109.148 -176.034 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 53.7 m -120.92 129.14 53.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.119 -0.946 . . . . 10.0 111.606 -170.744 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 81.2 m -125.64 145.77 50.01 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 123.666 0.786 . . . . 10.0 110.789 -172.597 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -32.75 -43.2 0.09 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 128.025 2.53 . . . . 10.0 113.932 176.71 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -28.58 -62.04 0.11 Allowed 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.839 2.056 . . . . 10.0 114.321 164.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.82 -28.19 12.58 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.489 1.116 . . . . 10.0 112.178 178.581 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -51.89 -41.58 62.05 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.826 -1.171 . . . . 10.0 112.085 170.753 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -62.56 -55.7 24.78 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 107.744 -1.206 . . . . 10.0 107.744 175.681 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.38 -33.22 29.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.809 0.844 . . . . 10.0 111.31 -179.71 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.37 -38.85 78.24 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 123.764 0.826 . . . . 10.0 111.749 -179.284 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 10.4 mt -79.4 -47.3 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.355 1.462 . . . . 10.0 111.036 174.937 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -48.25 -42.66 31.11 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 127.116 2.166 . . . . 10.0 112.049 171.428 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -44.41 -44.47 8.39 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.648 0.779 . . . . 10.0 112.185 175.882 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.499 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 3.2 mpp? -75.32 -70.7 0.41 Allowed 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.696 0.284 . . . . 10.0 111.435 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -161.71 32.59 0.13 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.155 0.798 . . . . 10.0 113.155 -178.923 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 39.42 55.36 2.3 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.088 1.355 . . . . 10.0 113.577 -179.098 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -140.08 -61.85 0.52 Allowed 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.532 -0.758 . . . . 10.0 112.372 178.78 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.436 ' HE3' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.731 0 N-CA-C 115.202 1.556 . . . . 10.0 115.202 -163.967 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 114.131 1.16 . . . . 10.0 114.131 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -156.61 159.87 38.88 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.529 1.532 . . . . 10.0 107.356 -174.95 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.51 -41.96 26.25 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 128.061 2.545 . . . . 10.0 112.082 179.116 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -57.14 -48.6 78.28 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 121.428 0.632 . . . . 10.0 109.702 175.011 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.91 -33.86 76.51 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.345 -175.63 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.0 mt -65.2 -52.22 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 CA-C-O 118.798 -0.62 . . . . 10.0 109.699 176.221 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.42 -38.12 80.92 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 117.142 -1.823 . . . . 10.0 111.313 -177.975 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -69.22 -22.48 63.87 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.69 1.596 . . . . 10.0 113.134 -179.438 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.94 -28.41 14.69 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.999 0.92 . . . . 10.0 113.241 170.631 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.1 -66.33 1.08 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.439 1.096 . . . . 10.0 112.474 -171.187 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.15 43.24 0.21 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 124.781 1.232 . . . . 10.0 111.127 178.12 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.8 t -129.24 -6.62 4.83 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 125.195 1.398 . . . . 10.0 113.816 -164.886 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.6 t -94.79 -43.98 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 124.052 0.941 . . . . 10.0 108.781 -175.245 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.0 m -104.43 -54.55 2.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 125.671 1.589 . . . . 10.0 109.257 -169.713 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -73.59 -13.41 61.01 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.351 1.46 . . . . 10.0 114.081 -172.896 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.3 t -73.01 -43.25 62.36 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.77 -0.581 . . . . 10.0 110.494 -178.144 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 16.3 tpp -112.18 -37.5 5.02 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.936 1.294 . . . . 10.0 112.999 179.917 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.98 58.98 1.27 Allowed Glycine 0 CA--C 1.534 1.268 0 C-N-CA 125.236 1.398 . . . . 10.0 113.461 -178.591 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 89.7 t -79.8 -60.28 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.615 -0.932 . . . . 10.0 112.711 -175.431 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.47 30.74 0.41 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.716 0.806 . . . . 10.0 111.171 178.884 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.57 6.69 81.72 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 124.348 0.975 . . . . 10.0 113.58 -173.466 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.43 135.83 69.97 Favored Pre-proline 0 CA--C 1.544 0.732 0 CA-C-N 118.07 0.935 . . . . 10.0 112.529 -176.272 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -69.36 149.83 69.93 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.917 3.078 . . . . 10.0 111.111 -175.335 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.427 ' HZ1' ' CE1' ' A' ' 26' ' ' HIS . 0.0 OUTLIER -76.63 134.48 39.3 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.156 0.583 . . . . 10.0 110.871 -163.985 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 94.8 p -39.7 -41.33 1.06 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.006 1.323 . . . . 10.0 114.1 178.142 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.427 ' CE1' ' HZ1' ' A' ' 24' ' ' LYS . 26.6 p-80 -131.94 113.64 13.67 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.033 1.733 . . . . 10.0 109.701 173.094 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -149.53 162.19 40.64 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.927 1.691 . . . . 10.0 107.682 174.167 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 99.5 m -107.53 -37.08 6.29 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.596 0.635 . . . . 10.0 111.686 170.127 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.36 -24.94 39.45 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 121.188 -0.945 . . . . 10.0 112.629 -176.76 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -77.33 -39.0 49.19 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.699 1.6 . . . . 10.0 108.947 177.879 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.406 ' CH2' ' HG3' ' A' ' 78' ' ' LYS . 60.1 m95 -80.87 -34.83 33.39 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.21 1.804 . . . . 10.0 112.427 179.568 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -40.18 -61.1 1.23 Allowed Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 115.033 1.494 . . . . 10.0 115.033 172.798 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -68.42 -4.67 13.38 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.333 2.689 . . . . 10.0 113.897 -179.014 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.0 -47.97 6.74 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.124 0.97 . . . . 10.0 108.652 172.234 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.72 16.76 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.83 1.652 . . . . 10.0 115.277 171.699 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.01 -24.05 22.45 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 120.99 -1.069 . . . . 10.0 110.835 -178.071 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.7 mptt -101.16 -48.78 4.29 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.024 0.93 . . . . 10.0 109.868 173.632 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.5 -124.73 1.85 Allowed Glycine 0 CA--C 1.528 0.855 0 N-CA-C 110.412 -1.075 . . . . 10.0 110.412 172.928 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -117.41 175.48 3.25 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.132 0 C-N-CA 125.316 1.446 . . . . 10.0 110.581 175.601 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 70.79 -45.04 0.6 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.078 1.751 . . . . 10.0 112.035 -174.868 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -44.0 -37.59 3.05 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.503 1.047 . . . . 10.0 111.928 -177.424 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -81.03 -43.6 19.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 125.677 1.591 . . . . 10.0 112.227 -179.715 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.81 -31.7 47.97 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 CA-C-O 121.545 0.688 . . . . 10.0 110.09 175.68 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -60.64 -51.06 70.98 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.579 -0.701 . . . . 10.0 112.284 169.871 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 54.1 m -62.28 -35.8 80.13 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 121.128 -0.983 . . . . 10.0 110.296 178.322 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.6 t -61.77 -54.8 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 C-N-CA 123.246 0.618 . . . . 10.0 111.294 177.413 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.72 -36.28 67.06 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 111.928 0.344 . . . . 10.0 111.928 177.059 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 50.0 m -72.37 -40.9 66.95 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.29 0.636 . . . . 10.0 112.566 178.26 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.32 114.86 0.77 Allowed Glycine 0 CA--C 1.528 0.861 0 N-CA-C 111.048 -0.821 . . . . 10.0 111.048 -168.103 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.91 -163.68 0.11 Allowed 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.436 0.695 . . . . 10.0 110.374 169.199 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -71.06 -62.58 1.34 Allowed 'General case' 0 N--CA 1.471 0.584 0 O-C-N 119.839 -1.788 . . . . 10.0 111.353 -172.445 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.74 -14.93 60.34 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.894 1.278 . . . . 10.0 112.586 173.717 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.8 ttp -102.69 120.79 51.73 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 123.181 0.592 . . . . 10.0 112.134 -172.582 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.33 155.26 70.85 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.079 1.852 . . . . 10.0 112.128 -173.183 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -57.94 130.21 37.14 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.373 2.715 . . . . 10.0 110.461 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.53 29.83 75.44 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 118.458 -1.19 . . . . 10.0 113.968 -172.4 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.4 29.3 3.75 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-N 118.984 1.392 . . . . 10.0 115.688 168.703 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.1 ttt 62.5 35.41 14.64 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.271 1.828 . . . . 10.0 114.195 -173.5 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.7 t -123.91 70.02 1.07 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.763 2.025 . . . . 10.0 109.427 -178.28 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 72.7 p 11.55 -96.42 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 128.82 2.848 . . . . 10.0 115.675 -178.826 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -125.7 54.87 1.47 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.913 1.285 . . . . 10.0 109.475 173.541 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 84.1 m -69.67 134.99 49.33 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.337 -0.852 . . . . 10.0 112.503 -178.655 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.59 140.39 33.86 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.622 1.169 . . . . 10.0 110.069 -178.184 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -39.27 -37.11 0.39 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.666 1.986 . . . . 10.0 113.496 176.711 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -36.39 -59.74 0.62 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.549 1.54 . . . . 10.0 113.539 166.147 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -97.59 -25.43 15.14 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.581 0.752 . . . . 10.0 110.992 179.762 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -54.18 48.96 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 120.826 -1.171 . . . . 10.0 110.612 176.276 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -61.83 -40.63 95.97 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.967 0.907 . . . . 10.0 110.219 -176.426 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -57.89 -30.75 66.12 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.949 -0.47 . . . . 10.0 111.735 171.007 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.77 -40.25 33.74 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 120.781 -1.199 . . . . 10.0 110.526 -173.001 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -43.03 78.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 122.799 0.439 . . . . 10.0 111.055 172.801 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -30.96 71.84 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.524 -0.735 . . . . 10.0 111.636 179.286 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -51.05 -48.23 61.58 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.873 -0.517 . . . . 10.0 112.241 171.454 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -64.51 -47.24 79.64 Favored 'General case' 0 CA--C 1.532 0.26 0 O-C-N 121.734 -0.604 . . . . 10.0 111.496 174.073 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.9 t -164.28 -78.18 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 120.28 -0.568 . . . . 10.0 111.72 175.98 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.3 pttt 163.09 45.03 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.659 2.784 . . . . 10.0 109.501 -176.624 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -152.45 -81.05 0.1 Allowed 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 114.528 1.307 . . . . 10.0 114.528 166.617 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.406 ' HG3' ' CH2' ' A' ' 31' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.254 1.299 0 N-CA-C 117.347 2.351 . . . . 10.0 117.347 -165.816 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.1 0 N-CA-C 111.443 0.164 . . . . 10.0 111.443 . . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -143.62 115.11 8.08 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 123.666 0.786 . . . . 10.0 109.177 172.02 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -43.87 -36.99 2.6 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.2 1.185 . . . . 10.0 114.2 167.997 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -54.49 -50.81 66.9 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 118.716 0.689 . . . . 10.0 110.468 170.533 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.74 -34.12 76.21 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 121.878 -0.513 . . . . 10.0 110.173 -175.638 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.2 mm -66.23 -51.05 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-O 118.041 -0.981 . . . . 10.0 110.113 176.42 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -67.59 -40.11 84.79 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 117.353 -1.739 . . . . 10.0 111.115 -179.916 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -69.07 -22.54 64.01 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.362 1.465 . . . . 10.0 112.637 -176.424 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -97.11 -26.66 14.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.443 1.097 . . . . 10.0 113.572 170.863 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -103.26 -68.35 0.84 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.954 1.302 . . . . 10.0 113.042 -175.599 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.65 41.99 0.28 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.469 1.508 . . . . 10.0 110.837 -178.476 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.4 t -126.76 -0.38 6.71 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 124.596 1.158 . . . . 10.0 113.52 -163.683 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 t -104.11 -53.14 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 C-N-CA 125.047 1.339 . . . . 10.0 108.573 -174.609 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.7 m -80.34 -65.8 0.96 Allowed 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.213 1.805 . . . . 10.0 110.192 176.333 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -72.91 -15.75 61.57 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.648 1.179 . . . . 10.0 113.983 -164.425 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.1 t -69.57 -41.24 76.09 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.827 -0.545 . . . . 10.0 110.829 -178.139 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.6 tpt -117.66 -35.76 3.86 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.889 1.276 . . . . 10.0 112.893 -177.468 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.89 56.46 1.31 Allowed Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.199 1.38 . . . . 10.0 113.693 179.927 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 64.0 t -78.49 -55.17 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 O-C-N 121.769 -0.842 . . . . 10.0 112.763 -176.046 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.05 32.83 0.44 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.739 0.815 . . . . 10.0 111.339 -179.076 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 62.0 32.21 81.37 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 123.926 0.774 . . . . 10.0 111.859 -169.914 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.65 148.23 82.39 Favored Pre-proline 0 CA--C 1.543 0.677 0 C-N-CA 123.656 0.782 . . . . 10.0 111.794 179.798 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -71.58 155.04 59.78 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 124.624 3.549 . . . . 10.0 110.481 -179.175 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -79.5 136.63 36.96 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.753 -0.592 . . . . 10.0 111.183 -172.525 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.7 m -37.13 -35.84 0.12 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.783 1.633 . . . . 10.0 114.67 169.742 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.4 p80 -131.81 117.44 18.55 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.374 1.07 . . . . 10.0 109.425 171.268 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -153.33 162.46 41.26 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 106.593 -1.632 . . . . 10.0 106.593 170.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 86.9 m -110.43 -36.35 5.8 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 118.21 0.459 . . . . 10.0 111.642 168.552 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.86 -25.24 37.81 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.289 -0.882 . . . . 10.0 113.046 -175.797 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . 0.436 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 65.1 t0 -79.18 -31.48 43.89 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.983 1.713 . . . . 10.0 109.383 176.057 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.459 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 56.7 m95 -84.02 -34.76 24.23 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.813 1.245 . . . . 10.0 111.285 179.481 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.85 -58.99 2.8 Favored Pre-proline 0 CA--C 1.551 0.984 0 N-CA-C 114.415 1.265 . . . . 10.0 114.415 173.451 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -73.72 6.79 2.64 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.33 2.687 . . . . 10.0 114.065 -178.784 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.74 -42.0 5.51 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.981 0.912 . . . . 10.0 108.67 169.659 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.89 22.1 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 115.159 1.54 . . . . 10.0 115.159 164.73 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.18 -36.96 14.49 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 120.955 -1.091 . . . . 10.0 110.023 178.768 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -76.35 -54.94 6.04 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.977 174.005 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 136.37 50.76 0.07 OUTLIER Glycine 0 CA--C 1.534 1.261 0 CA-C-O 119.334 -0.703 . . . . 10.0 114.808 168.483 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.9 t 62.03 165.36 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.861 1.264 . . . . 10.0 111.906 -179.67 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 77.41 -50.96 0.54 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.417 1.487 . . . . 10.0 110.738 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -38.23 -41.08 0.57 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.655 1.182 . . . . 10.0 111.942 172.091 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -68.37 -50.89 49.95 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 124.596 1.158 . . . . 10.0 111.293 -179.436 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -50.45 -29.29 6.28 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 C-N-CA 124.321 1.049 . . . . 10.0 112.357 167.541 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.67 -37.36 27.55 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 120.676 -1.265 . . . . 10.0 114.362 173.64 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.5 m -76.0 -16.9 59.89 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.451 1.1 . . . . 10.0 111.421 173.767 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.5 p -89.05 -41.23 13.82 Favored 'Isoleucine or valine' 0 C--N 1.34 0.167 0 O-C-N 121.666 -0.646 . . . . 10.0 111.801 175.119 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -39.3 63.32 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.91 0.862 . . . . 10.0 110.942 177.315 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.5 t -73.34 -39.1 65.48 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.277 1.431 . . . . 10.0 112.243 178.256 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 82.5 99.84 0.47 Allowed Glycine 0 CA--C 1.532 1.124 0 C-N-CA 123.36 0.505 . . . . 10.0 111.99 -174.961 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.6 tp -58.56 168.88 1.03 Allowed 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.947 -0.737 . . . . 10.0 111.693 170.026 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -46.96 -57.96 4.45 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.531 1.532 . . . . 10.0 113.547 -174.336 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.69 14.77 7.87 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 114.367 -1.288 . . . . 10.0 112.538 177.138 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -110.96 153.51 43.78 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 114.795 1.406 . . . . 10.0 114.795 171.678 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -72.58 154.13 54.88 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.564 2.176 . . . . 10.0 110.737 169.327 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -62.09 132.41 39.09 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.641 2.227 . . . . 10.0 108.408 175.783 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.11 30.21 76.79 Favored Glycine 0 C--N 1.338 0.648 0 C-N-CA 118.946 -1.597 . . . . 10.0 112.357 179.697 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.57 32.28 2.8 Favored Glycine 0 CA--C 1.541 1.668 0 CA-C-N 118.076 0.938 . . . . 10.0 113.987 -179.121 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.1 ttt 70.19 44.42 0.76 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.019 1.728 . . . . 10.0 113.224 -176.438 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.07 156.32 40.17 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.99 1.316 . . . . 10.0 111.572 178.555 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 49.0 m -112.16 -91.97 0.48 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.275 1.03 . . . . 10.0 109.74 -179.257 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -89.8 66.53 7.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.875 1.27 . . . . 10.0 109.52 178.625 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 62.7 m -117.96 127.24 53.64 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.558 1.143 . . . . 10.0 111.429 -176.126 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 85.6 m -122.57 146.14 47.7 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.75 0.82 . . . . 10.0 109.927 -173.129 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -37.26 -42.45 0.46 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.983 2.113 . . . . 10.0 113.43 -178.406 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -35.87 -53.2 0.74 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.263 1.425 . . . . 10.0 113.905 172.296 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.56 -33.51 10.29 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.741 0.816 . . . . 10.0 111.655 173.823 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.04 -40.13 57.53 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.616 -1.302 . . . . 10.0 112.043 177.981 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.2 pttt -69.1 -48.25 63.09 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 123.387 0.675 . . . . 10.0 109.972 178.053 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.25 -32.34 62.25 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.374 0.534 . . . . 10.0 111.802 175.102 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.54 -42.45 82.68 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.985 0.914 . . . . 10.0 109.934 -178.76 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -67.92 -51.83 45.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 125.999 1.72 . . . . 10.0 111.773 173.193 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -58.81 -32.7 69.6 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.236 1.415 . . . . 10.0 111.966 178.057 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -47.3 -50.46 21.59 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.275 0.488 . . . . 10.0 111.845 175.987 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.459 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.2 mpp? -66.73 -45.71 77.79 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.966 0.358 . . . . 10.0 111.966 179.002 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.2 t -162.59 -71.48 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.015 0.526 . . . . 10.0 111.567 176.712 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.2 pttt 160.43 50.11 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.38 2.672 . . . . 10.0 110.972 -175.097 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.1 -80.95 0.05 OUTLIER 'General case' 0 C--O 1.224 -0.282 0 O-C-N 121.271 -0.893 . . . . 10.0 113.043 171.711 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.436 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 6.4 ptpp? . . . . . 0 C--O 1.251 1.158 0 N-CA-C 114.832 1.419 . . . . 10.0 114.832 -178.584 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 . . . . . 0 CA--C 1.542 0.653 0 N-CA-C 114.313 1.227 . . . . 10.0 114.313 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . 0.469 ' CG ' ' H ' ' A' ' 3' ' ' ALA . 23.1 t70 -134.81 -129.49 0.16 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.591 1.556 . . . . 10.0 111.28 -167.518 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.469 ' H ' ' CG ' ' A' ' 2' ' ' ASP . . . -149.7 -52.2 0.15 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 129.977 3.311 . . . . 10.0 109.112 -173.77 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -57.67 -49.28 77.02 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 121.441 0.639 . . . . 10.0 110.154 174.35 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.61 -30.9 70.61 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.902 -0.499 . . . . 10.0 110.775 -176.11 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.95 -51.5 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 N-CA-C 108.678 -0.86 . . . . 10.0 108.678 -179.835 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.36 -42.84 78.62 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 119.625 -0.83 . . . . 10.0 110.837 178.811 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -67.35 -22.4 65.59 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.002 1.321 . . . . 10.0 111.94 -176.13 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.77 -30.81 16.81 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.015 1.117 . . . . 10.0 114.015 167.303 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.03 -65.64 1.14 Allowed 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.893 1.224 . . . . 10.0 113.147 -171.094 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.28 43.83 0.31 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.146 1.378 . . . . 10.0 110.175 178.412 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.9 t -124.63 -3.25 7.82 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 125.076 1.35 . . . . 10.0 113.803 -166.254 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -103.2 -48.11 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 124.312 1.045 . . . . 10.0 108.554 -174.268 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.4 m -85.09 -66.28 0.91 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.748 1.619 . . . . 10.0 110.757 174.157 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -73.87 -19.37 60.74 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.824 1.416 . . . . 10.0 114.824 -163.22 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.2 t -64.79 -54.83 25.02 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.038 0.535 . . . . 10.0 111.035 175.543 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.7 tpt -97.0 -20.16 18.26 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.725 0.81 . . . . 10.0 112.747 -177.841 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.58 42.67 6.4 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 125.563 1.554 . . . . 10.0 112.3 -173.665 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 15.3 t -81.01 159.28 4.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 O-C-N 121.693 -0.886 . . . . 10.0 109.146 176.505 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.53 19.84 5.65 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.914 1.286 . . . . 10.0 113.37 -174.939 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.6 24.35 76.34 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 123.906 0.765 . . . . 10.0 113.127 -173.476 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.43 145.32 87.67 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 118.596 1.198 . . . . 10.0 113.533 -177.782 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -75.17 145.9 31.41 Favored 'Trans proline' 0 N--CA 1.454 -0.828 1 C-N-CA 125.512 4.142 . . . . 10.0 109.825 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -66.77 152.41 45.56 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-O 122.354 1.073 . . . . 10.0 112.137 -167.048 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.6 p -49.26 -33.18 12.27 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.721 1.608 . . . . 10.0 112.592 167.426 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -142.1 74.14 1.44 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.151 1.38 . . . . 10.0 111.947 -177.335 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 15.5 m-20 -103.41 166.27 10.53 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.767 1.227 . . . . 10.0 108.927 166.928 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.5 t -110.19 -36.03 5.94 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 166.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.87 -23.92 41.57 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.654 -1.279 . . . . 10.0 112.535 -176.86 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -79.21 -29.79 42.98 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.165 1.386 . . . . 10.0 110.509 178.455 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.7 m95 -89.64 -38.59 13.8 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.322 1.849 . . . . 10.0 111.091 -179.495 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -39.43 -61.97 0.9 Allowed Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 114.709 1.374 . . . . 10.0 114.709 174.961 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.04 -1.82 9.35 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.353 2.702 . . . . 10.0 113.862 -177.572 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 56.1 mmt-85 -98.9 -47.31 5.32 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.486 1.514 . . . . 10.0 108.695 176.665 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.15 -10.16 4.12 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 126.227 1.811 . . . . 10.0 113.656 172.762 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.81 -27.74 58.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.17 1.388 . . . . 10.0 109.503 178.179 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -92.96 -56.87 2.83 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.856 0.463 . . . . 10.0 110.51 169.412 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.435 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 165.47 -122.39 1.07 Allowed Glycine 0 CA--C 1.529 0.928 0 N-CA-C 111.567 -0.613 . . . . 10.0 111.567 179.864 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.3 p -151.4 -56.42 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 117.719 0.759 . . . . 10.0 111.352 -178.777 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.07 1.78 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.999 1.481 . . . . 10.0 114.999 171.748 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.435 HD22 ' N ' ' A' ' 38' ' ' GLY . 1.9 m-80 -69.7 -59.39 2.98 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.085 -1.009 . . . . 10.0 109.806 164.824 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.9 mp -80.09 -20.89 44.05 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.38 -0.825 . . . . 10.0 111.042 -166.436 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.13 -15.68 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 124.285 1.034 . . . . 10.0 112.452 164.005 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -82.57 -35.21 27.36 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.086 -1.009 . . . . 10.0 111.819 168.15 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 7.8 t -69.69 -44.77 69.73 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 123.481 0.713 . . . . 10.0 110.277 177.663 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 3.6 p -58.58 -41.61 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 123.24 0.616 . . . . 10.0 111.632 -179.148 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.427 ' NZ ' ' OD1' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -70.88 -28.51 64.61 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.966 -0.459 . . . . 10.0 111.781 179.505 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.3 m -76.23 -35.09 59.18 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.865 1.266 . . . . 10.0 112.507 172.656 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.72 105.05 0.3 Allowed Glycine 0 CA--C 1.525 0.684 0 C-N-CA 123.727 0.679 . . . . 10.0 111.873 -170.345 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.4 tp -68.07 174.51 3.77 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 122.095 -0.65 . . . . 10.0 110.252 170.338 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.414 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 15.3 m-80 -49.57 -54.75 16.44 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.598 -1.314 . . . . 10.0 113.138 -172.67 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -88.78 16.02 7.44 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.398 1.479 . . . . 10.0 112.95 175.76 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -122.98 142.96 39.42 Favored Pre-proline 0 CA--C 1.545 0.784 0 N-CA-C 115.024 1.49 . . . . 10.0 115.024 175.955 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.64 139.92 41.86 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 121.885 1.723 . . . . 10.0 110.835 177.171 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -60.95 119.91 7.33 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.938 2.425 . . . . 10.0 109.582 177.187 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 86.93 12.65 68.08 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 119.625 -1.274 . . . . 10.0 112.643 -175.343 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 60.29 14.6 34.24 Favored Glycine 0 CA--C 1.54 1.614 0 CA-C-N 119.478 1.639 . . . . 10.0 114.579 171.415 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.4 ttt 41.82 45.62 3.18 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.445 2.298 . . . . 10.0 114.525 -175.357 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.8 p -115.56 24.86 11.23 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.628 1.171 . . . . 10.0 113.388 178.63 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.6 m 65.0 -127.97 0.35 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.699 0.8 . . . . 10.0 110.422 177.087 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -79.29 60.0 2.98 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.826 1.25 . . . . 10.0 110.999 -179.304 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 2.8 m -60.9 96.34 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.995 0.918 . . . . 10.0 112.076 -177.452 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.3 t -88.46 129.66 35.38 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 121.072 -1.017 . . . . 10.0 108.386 176.672 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.427 ' OD1' ' NZ ' ' A' ' 47' ' ' LYS . 5.8 m-20 -38.83 -38.5 0.43 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.979 1.712 . . . . 10.0 113.137 178.514 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -43.4 -59.44 2.13 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.264 1.425 . . . . 10.0 112.23 169.183 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -80.7 -37.4 30.73 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.965 0.888 . . . . 10.0 110.344 -179.231 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.6 -46.88 73.89 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.394 1.078 . . . . 10.0 111.161 -179.3 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.8 pttt -72.77 -47.61 45.25 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 124.386 1.074 . . . . 10.0 108.869 -179.639 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.63 -41.1 21.27 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.73 0.412 . . . . 10.0 111.791 173.727 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.76 -53.78 53.16 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.224 0.609 . . . . 10.0 111.237 179.758 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 31.7 pt -71.65 -31.5 42.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 O-C-N 120.961 -1.087 . . . . 10.0 112.84 179.579 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -58.24 -40.45 81.77 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.409 0.684 . . . . 10.0 111.352 167.478 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -51.82 -43.76 63.25 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.508 0.559 . . . . 10.0 112.508 177.165 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -70.37 0.27 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.909 0.337 . . . . 10.0 111.909 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.2 t -162.45 31.56 0.11 Allowed 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.833 0.679 . . . . 10.0 112.833 -178.973 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.4 ptpt 35.58 51.1 0.64 Allowed 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 115.624 1.713 . . . . 10.0 115.624 178.786 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.17 -49.82 0.94 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.629 0.974 . . . . 10.0 113.629 -176.092 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.7 pttp . . . . . 0 C--O 1.249 1.049 0 CA-C-O 116.606 -1.664 . . . . 10.0 112.08 -177.266 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 . . . . . 0 CA--C 1.531 0.244 0 N-CA-C 112.759 0.652 . . . . 10.0 112.759 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -152.0 114.58 4.58 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 121.951 0.882 . . . . 10.0 109.32 174.98 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.25 -28.25 57.86 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 114.212 1.19 . . . . 10.0 114.212 174.31 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -56.24 -48.33 76.72 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 119.093 0.86 . . . . 10.0 110.426 166.812 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 -34.55 76.48 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.792 -0.568 . . . . 10.0 110.176 -178.019 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.2 mm -65.49 -51.17 66.8 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 CA-C-O 118.871 -0.585 . . . . 10.0 109.668 176.939 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.409 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -68.11 -41.1 82.29 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 118.176 -1.41 . . . . 10.0 111.014 -178.899 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -69.05 -22.28 64.04 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.363 1.465 . . . . 10.0 112.755 -178.06 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.45 -29.07 16.45 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.31 1.044 . . . . 10.0 113.554 168.559 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.3 -65.08 1.19 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.806 1.185 . . . . 10.0 112.952 -172.192 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.409 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -74.46 39.74 0.13 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.542 1.537 . . . . 10.0 111.322 178.655 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.7 t -126.71 3.34 6.74 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 125.084 1.353 . . . . 10.0 113.676 -165.16 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.3 t -100.91 -38.72 6.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 124.604 1.162 . . . . 10.0 108.685 -177.355 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.3 m -110.28 -58.73 2.03 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 126.263 1.825 . . . . 10.0 109.65 -170.275 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 26.3 m-70 -73.48 -25.7 60.58 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.289 0.848 . . . . 10.0 113.289 -173.394 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.18 -51.27 64.9 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.903 0.881 . . . . 10.0 110.499 -177.393 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -111.44 -23.29 10.84 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.771 1.228 . . . . 10.0 112.358 -177.878 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.83 59.96 1.16 Allowed Glycine 0 CA--C 1.537 1.44 0 C-N-CA 124.381 0.991 . . . . 10.0 112.518 -175.513 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 25.6 t -104.74 159.65 5.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 125.515 1.526 . . . . 10.0 109.638 178.237 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.54 23.08 10.41 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.441 1.096 . . . . 10.0 113.178 -176.08 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.24 10.06 86.46 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.304 0.954 . . . . 10.0 113.468 -174.441 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.51 149.62 98.26 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 118.622 1.211 . . . . 10.0 111.451 179.087 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -76.41 163.94 31.5 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 123.859 3.039 . . . . 10.0 110.09 -177.398 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -71.31 141.04 50.49 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.589 -0.694 . . . . 10.0 111.776 -178.087 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.7 t -35.63 -37.79 0.1 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 127.233 2.213 . . . . 10.0 114.327 171.444 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.4 p-80 -139.57 118.43 12.46 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 108.106 -1.072 . . . . 10.0 108.106 168.812 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -138.19 161.2 37.45 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.299 -1.371 . . . . 10.0 107.299 168.793 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.7 t -106.55 -33.24 7.74 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 117.514 0.143 . . . . 10.0 111.255 169.335 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.84 -36.1 70.07 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 120.412 -1.43 . . . . 10.0 113.485 -179.941 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -80.54 -21.87 41.39 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.033 0.533 . . . . 10.0 110.908 -178.314 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 62.9 m95 -93.87 -34.88 12.96 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.659 1.583 . . . . 10.0 109.945 -178.21 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -41.39 -63.02 0.89 Allowed Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 124.786 1.234 . . . . 10.0 114.296 175.003 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -73.24 5.42 3.15 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.86 2.373 . . . . 10.0 113.975 -178.224 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -106.37 -44.08 4.61 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.476 1.91 . . . . 10.0 109.463 174.081 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.25 12.21 0.47 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.755 2.022 . . . . 10.0 113.191 173.764 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.94 -27.69 28.35 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 125.124 1.369 . . . . 10.0 109.914 177.649 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -90.93 -56.78 3.05 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.142 0.577 . . . . 10.0 110.831 175.218 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 150.32 -124.78 1.81 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 110.949 -0.86 . . . . 10.0 110.949 175.748 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -126.23 177.55 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 125.528 1.531 . . . . 10.0 110.041 176.335 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.6 t70 73.8 -43.55 0.55 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.779 1.231 . . . . 10.0 111.614 -171.249 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.32 -48.7 65.28 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 120.691 -1.256 . . . . 10.0 112.537 -174.028 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.7 mt -88.54 -37.67 15.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.603 1.161 . . . . 10.0 111.011 -173.513 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -58.26 -29.19 36.96 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.426 0.631 . . . . 10.0 110.382 171.699 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.4 mtpt -63.86 -52.48 59.85 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 120.395 -1.441 . . . . 10.0 114.243 168.884 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.23 -33.12 70.62 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.155 -0.966 . . . . 10.0 109.872 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.54 -42.03 83.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 115.352 -0.84 . . . . 10.0 111.985 174.954 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.82 -25.54 35.08 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.446 0.641 . . . . 10.0 111.71 -177.776 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 54.9 m -73.55 -32.98 64.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.944 0.897 . . . . 10.0 112.312 174.03 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 89.54 124.19 2.51 Favored Glycine 0 C--N 1.343 0.923 0 CA-C-N 119.755 1.161 . . . . 10.0 111.634 -174.194 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.43 -157.54 0.79 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.139 0.976 . . . . 10.0 111.91 176.155 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -68.03 138.48 55.88 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-O 122.524 1.154 . . . . 10.0 109.508 -179.311 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 56.29 18.86 3.58 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 111.516 -2.584 . . . . 10.0 112.003 176.459 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.0 ttp -136.89 121.64 12.64 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 123.993 0.917 . . . . 10.0 111.265 -171.733 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -68.36 143.89 59.84 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 121.602 1.535 . . . . 10.0 111.632 -174.971 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -62.16 113.95 2.11 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.43 2.753 . . . . 10.0 109.618 178.685 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 104.84 20.62 9.76 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 123.488 0.493 . . . . 10.0 112.75 -175.502 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 51.39 34.45 33.97 Favored Glycine 0 CA--C 1.54 1.605 0 CA-C-N 119.286 1.543 . . . . 10.0 114.116 177.434 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.0 ttt 65.16 23.12 12.31 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.15 1.78 . . . . 10.0 113.222 -176.554 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.3 t -121.91 155.61 35.1 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.725 1.21 . . . . 10.0 112.06 -170.732 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 80.2 m -88.49 -66.38 0.92 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.646 0.779 . . . . 10.0 111.139 179.736 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -124.46 63.78 1.1 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.403 1.081 . . . . 10.0 109.416 -177.747 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.0 m -81.54 118.89 23.12 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 121.686 -0.634 . . . . 10.0 110.45 172.01 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 62.2 m -108.28 135.44 49.6 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 108.345 -0.983 . . . . 10.0 108.345 179.707 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -32.38 -46.09 0.12 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.722 2.009 . . . . 10.0 114.477 -179.719 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -28.35 -60.85 0.12 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.682 1.993 . . . . 10.0 113.324 167.779 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.18 -37.14 12.26 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.937 0.895 . . . . 10.0 111.988 173.127 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.67 -39.07 50.03 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.985 -1.072 . . . . 10.0 112.311 -177.373 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.7 ptmt -75.51 -50.62 15.14 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.746 1.219 . . . . 10.0 109.361 178.671 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.87 -30.81 15.5 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.575 0.75 . . . . 10.0 111.955 179.174 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.05 -44.85 94.69 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.546 0.738 . . . . 10.0 111.663 175.257 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 19.0 mt -73.18 -41.22 58.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 126.681 1.992 . . . . 10.0 111.086 177.425 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -63.83 -33.79 76.47 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.583 1.153 . . . . 10.0 111.862 174.836 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -55.13 -34.36 63.66 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 112.496 0.554 . . . . 10.0 112.496 171.282 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 65.6 mtm -86.43 -72.48 0.5 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.709 0.804 . . . . 10.0 112.229 -178.839 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -158.34 34.16 0.24 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.515 0.561 . . . . 10.0 112.515 178.064 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt 42.68 52.28 4.96 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.748 1.619 . . . . 10.0 113.86 172.237 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -158.94 -81.73 0.05 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.481 1.112 . . . . 10.0 112.656 173.233 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.229 0 N-CA-C 115.66 1.726 . . . . 10.0 115.66 -171.058 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.466 0.327 0 N-CA-C 113.468 0.914 . . . . 10.0 113.468 . . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -146.05 -175.79 4.9 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 105.437 -2.06 . . . . 10.0 105.437 177.04 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -93.58 -44.32 8.26 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 126.215 1.806 . . . . 10.0 112.941 169.023 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -54.41 -37.74 65.42 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.528 0.68 . . . . 10.0 110.163 -177.451 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.94 -28.96 43.79 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.905 0.882 . . . . 10.0 113.087 174.802 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.28 -51.39 43.4 Favored 'Isoleucine or valine' 0 C--N 1.339 0.126 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 179.629 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -68.05 -29.46 68.44 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.363 -0.836 . . . . 10.0 111.035 -176.36 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.11 -23.29 65.82 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 126.072 1.749 . . . . 10.0 114.069 174.063 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 tppt? -100.66 -27.89 13.14 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.357 0.873 . . . . 10.0 113.357 172.174 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.99 -72.3 0.73 Allowed 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 124.988 1.315 . . . . 10.0 110.978 -167.068 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.74 37.3 0.14 Allowed 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.731 1.212 . . . . 10.0 110.667 179.043 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.0 t -120.53 -1.99 10.03 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.023 1.729 . . . . 10.0 114.041 -169.949 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 t -100.87 -39.89 7.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 122.362 1.077 . . . . 10.0 108.491 -174.275 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.0 m -101.09 -63.53 1.13 Allowed 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 128.003 2.521 . . . . 10.0 110.352 -177.709 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.4 m-70 -74.06 -29.15 61.75 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.483 1.29 . . . . 10.0 114.483 -168.693 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.1 m -54.8 -47.26 74.22 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.655 0.782 . . . . 10.0 110.881 178.59 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.4 ttt -116.26 -10.7 11.38 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.035 0.934 . . . . 10.0 112.526 -174.135 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.32 48.31 6.91 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 123.854 0.74 . . . . 10.0 112.85 -178.491 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 86.7 t -88.11 158.14 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 C-N-CA 125.438 1.495 . . . . 10.0 109.055 176.936 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.84 22.49 8.65 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.697 0.999 . . . . 10.0 113.697 -175.204 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.3 8.37 70.24 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 123.694 0.664 . . . . 10.0 113.332 -172.629 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.16 142.47 85.86 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 118.26 1.03 . . . . 10.0 111.713 -178.638 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -73.59 150.08 44.92 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.879 2.386 . . . . 10.0 111.092 -179.329 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.62 151.36 13.89 Favored 'General case' 0 C--O 1.245 0.851 0 CA-C-O 122.455 1.121 . . . . 10.0 112.482 -174.293 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.0 p -56.35 -34.35 66.53 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.104 2.562 . . . . 10.0 112.945 173.795 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -141.05 51.48 1.6 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.8 0.809 . . . . 10.0 112.41 177.275 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -69.64 161.62 29.31 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.133 -0.98 . . . . 10.0 109.948 170.592 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.4 t -107.86 -32.79 7.46 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.874 -0.516 . . . . 10.0 111.543 165.115 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.36 -24.78 39.57 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.42 -1.425 . . . . 10.0 113.587 -177.34 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.66 -18.98 39.12 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.745 1.618 . . . . 10.0 111.6 175.498 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -103.52 -34.19 8.76 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.744 1.618 . . . . 10.0 110.736 -176.853 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -43.29 -57.4 5.41 Favored Pre-proline 0 CA--C 1.545 0.786 0 CA-C-N 119.462 1.028 . . . . 10.0 113.637 170.991 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.12 3.53 3.94 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 122.187 1.925 . . . . 10.0 113.52 -179.308 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' ARG . . . . . 0.413 ' C ' ' H ' ' A' ' 36' ' ' ALA . 8.0 mmt85 -104.74 -47.89 3.93 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.765 1.626 . . . . 10.0 108.728 178.374 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.0 0.16 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.38 2.272 . . . . 10.0 114.246 168.122 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.413 ' H ' ' C ' ' A' ' 34' ' ' ARG . . . -87.69 -22.28 24.74 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.808 1.243 . . . . 10.0 110.484 175.678 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.9 mtmm -106.16 -63.45 1.26 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.565 0.746 . . . . 10.0 111.056 174.37 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.427 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 156.95 -165.31 33.12 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 111.363 -0.695 . . . . 10.0 111.363 -176.254 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . 0.426 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.3 OUTLIER -100.87 -41.77 9.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 124.329 1.052 . . . . 10.0 111.739 178.671 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.49 10.42 0.06 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.819 2.048 . . . . 10.0 114.694 -177.028 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.427 HD22 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -105.9 -58.06 1.96 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 126.192 1.797 . . . . 10.0 107.099 178.331 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.5 mt -72.46 -30.67 64.78 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.022 -0.99 . . . . 10.0 109.847 -174.392 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 p -60.99 -33.23 54.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-O 121.745 0.783 . . . . 10.0 110.879 171.863 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -69.73 -41.74 74.9 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.236 -0.915 . . . . 10.0 110.609 177.696 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.1 m -63.15 -36.0 82.16 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.458 -0.776 . . . . 10.0 110.317 174.294 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.5 t -60.52 -51.05 77.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 121.145 0.497 . . . . 10.0 111.647 179.375 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -33.61 72.39 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.078 0.466 . . . . 10.0 112.256 176.657 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.1 m -73.38 -33.07 64.84 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.822 0.849 . . . . 10.0 112.048 179.535 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.28 114.82 0.16 Allowed Glycine 0 CA--C 1.528 0.89 0 N-CA-C 111.195 -0.762 . . . . 10.0 111.195 -169.479 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.28 -157.33 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.145 0.978 . . . . 10.0 110.563 167.873 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -72.24 -63.35 1.16 Allowed 'General case' 0 N--CA 1.476 0.848 0 O-C-N 119.367 -2.083 . . . . 10.0 111.388 -175.167 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.72 -19.43 60.24 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.961 1.305 . . . . 10.0 111.742 176.608 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.1 ttp -97.43 120.35 61.03 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 123.405 0.682 . . . . 10.0 111.757 -173.216 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -69.42 155.69 66.35 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 121.715 1.61 . . . . 10.0 111.941 -173.273 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -63.95 117.82 4.8 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.997 2.465 . . . . 10.0 109.515 -177.564 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.08 30.48 9.32 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 120.997 -0.62 . . . . 10.0 112.78 -175.201 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 66.74 -63.53 0.18 Allowed Glycine 0 CA--C 1.534 1.252 0 C-N-CA 126.499 1.999 . . . . 10.0 114.665 174.161 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.8 ttp -171.84 -39.05 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.686 2.394 . . . . 10.0 110.685 171.82 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.51 -31.21 53.35 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 122.097 -0.377 . . . . 10.0 111.782 -178.604 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.8 m 72.76 -62.4 0.47 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.686 1.194 . . . . 10.0 112.592 -178.19 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -79.3 54.28 1.66 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.944 0.898 . . . . 10.0 110.579 -179.215 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.84 121.51 45.25 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.256 1.023 . . . . 10.0 109.718 -175.072 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 m -80.94 149.27 29.45 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.031 0.932 . . . . 10.0 110.53 -174.317 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -49.14 -40.21 31.76 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 120.121 1.328 . . . . 10.0 112.563 179.493 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -55.78 -38.8 70.39 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 113.521 0.934 . . . . 10.0 113.521 173.54 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -84.66 -38.27 20.01 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.876 1.27 . . . . 10.0 111.382 177.245 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -63.38 -55.1 27.21 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.376 -1.452 . . . . 10.0 111.426 178.157 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -48.99 74.43 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 107.573 -1.269 . . . . 10.0 107.573 -175.487 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.2 -31.52 53.21 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.367 0.506 . . . . 10.0 112.367 177.0 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.59 -50.14 53.94 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 119.206 0.912 . . . . 10.0 110.765 177.043 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 8.9 mt -60.54 -41.9 89.5 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.516 1.126 . . . . 10.0 111.701 176.232 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -65.41 -43.69 89.79 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.597 1.959 . . . . 10.0 112.374 175.138 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -55.61 -35.91 66.37 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.705 0.631 . . . . 10.0 112.705 174.501 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 56.2 mtm -76.61 -78.97 0.11 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.015 0.746 . . . . 10.0 113.015 179.787 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.4 t -151.62 37.06 0.58 Allowed 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.353 -0.842 . . . . 10.0 111.113 174.986 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 39.74 58.02 2.13 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.45 1.5 . . . . 10.0 113.5 172.923 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -155.02 -75.82 0.11 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.022 -0.99 . . . . 10.0 113.435 177.783 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.245 0 C-N-CA 125.903 1.681 . . . . 10.0 112.978 -171.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.198 0 CA-C-O 119.228 -0.415 . . . . 10.0 110.641 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -159.83 125.86 4.26 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.404 1.082 . . . . 10.0 108.294 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -109.11 58.11 0.61 Allowed 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 126.087 1.755 . . . . 10.0 109.164 178.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -95.44 -20.09 19.35 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.075 -0.966 . . . . 10.0 110.548 177.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -145.02 122.8 11.89 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.987 -0.745 . . . . 10.0 108.987 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -53.86 -39.14 65.41 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.12 0.968 . . . . 10.0 112.573 172.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -58.67 -47.42 84.53 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 110.277 -0.268 . . . . 10.0 110.277 171.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.34 -31.78 72.28 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.426 -0.796 . . . . 10.0 110.688 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.5 mm -66.32 -50.98 63.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-O 118.442 -0.789 . . . . 10.0 110.145 176.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.18 -43.13 78.85 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 117.891 -1.524 . . . . 10.0 111.233 178.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.96 -22.57 64.11 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.376 1.47 . . . . 10.0 112.593 -175.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt -91.35 -31.57 16.02 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.408 -0.807 . . . . 10.0 113.178 168.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.48 -65.93 1.11 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.453 1.024 . . . . 10.0 112.506 -169.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.88 40.18 0.14 Allowed 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.088 1.355 . . . . 10.0 111.176 177.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.8 t -123.37 3.45 9.11 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 125.252 1.421 . . . . 10.0 113.779 -165.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 40.8 t -105.98 -46.83 8.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 124.234 1.013 . . . . 10.0 108.597 -174.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.6 m -91.01 -63.98 1.19 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 126.595 1.958 . . . . 10.0 111.471 177.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -73.32 -22.93 60.22 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.493 1.117 . . . . 10.0 113.977 -165.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.67 -53.74 54.82 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.157 0.983 . . . . 10.0 110.543 179.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 37.5 mmt -102.1 -23.8 14.02 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.402 1.081 . . . . 10.0 112.135 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.15 49.12 2.92 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 124.25 0.929 . . . . 10.0 112.04 -175.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 79.3 t -93.77 161.39 2.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.29 1.436 . . . . 10.0 109.397 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.07 18.9 6.76 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.456 1.102 . . . . 10.0 113.436 -174.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.3 18.43 76.23 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 124.566 1.079 . . . . 10.0 113.209 -173.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.56 145.53 90.19 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 118.525 1.162 . . . . 10.0 113.725 -172.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.88 137.21 17.47 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 125.047 3.832 . . . . 10.0 110.02 -177.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.24 139.69 58.8 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 123.95 0.9 . . . . 10.0 112.567 -163.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.5 p -51.31 -32.53 25.51 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.508 1.123 . . . . 10.0 113.249 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -134.2 115.34 14.06 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.694 1.197 . . . . 10.0 109.369 171.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -154.58 166.18 34.14 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 125.521 1.528 . . . . 10.0 108.425 176.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 56.5 m -110.13 -36.01 5.95 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 117.776 0.262 . . . . 10.0 111.637 168.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.49 -21.41 35.52 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.305 -0.872 . . . . 10.0 113.268 -176.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -78.67 -30.56 46.25 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.769 2.028 . . . . 10.0 109.528 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.422 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 65.1 m95 -92.67 -35.42 13.51 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 126.546 1.939 . . . . 10.0 111.849 -179.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -43.18 -56.84 5.95 Favored Pre-proline 0 CA--C 1.549 0.94 0 N-CA-C 115.087 1.514 . . . . 10.0 115.087 175.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -67.95 -7.51 19.92 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.739 2.293 . . . . 10.0 113.413 -179.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -93.42 -51.62 4.89 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.684 1.194 . . . . 10.0 109.061 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.77 8.78 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.868 1.667 . . . . 10.0 115.257 169.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.34 -37.92 14.53 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.977 0.911 . . . . 10.0 109.443 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -93.05 -38.72 11.48 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.01 0.924 . . . . 10.0 111.313 176.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 157.29 -143.56 9.69 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 111.325 -0.71 . . . . 10.0 111.325 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.9 t -127.04 -60.45 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 C-N-CA 123.734 0.814 . . . . 10.0 110.608 -176.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -44.96 -33.55 2.06 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.369 1.868 . . . . 10.0 113.653 176.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -48.34 -24.3 1.18 Allowed 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.101 1.36 . . . . 10.0 113.687 173.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -94.74 -47.04 6.65 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 125.431 1.492 . . . . 10.0 111.387 177.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -51.96 -34.73 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 CA-C-N 119.434 1.015 . . . . 10.0 111.943 172.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -67.62 -44.01 79.03 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.525 -1.36 . . . . 10.0 112.627 169.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.5 m -64.08 -43.0 96.77 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.153 -0.967 . . . . 10.0 110.306 -177.028 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 7.6 p -65.64 -48.84 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 124.268 1.027 . . . . 10.0 111.634 178.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.59 -31.93 72.83 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.471 0.653 . . . . 10.0 110.828 176.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.3 m -74.04 -33.91 63.9 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.464 -0.772 . . . . 10.0 112.445 176.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 89.01 113.89 1.31 Allowed Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.587 -1.005 . . . . 10.0 110.587 -169.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.29 -170.03 0.9 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.985 0.514 . . . . 10.0 109.873 165.238 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -66.58 -57.02 8.11 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 119.904 -1.747 . . . . 10.0 111.745 -172.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.68 1.69 28.99 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 113.76 -1.564 . . . . 10.0 112.397 176.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 43.4 mtp -109.67 140.73 22.46 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 112.788 0.662 . . . . 10.0 112.788 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.9 149.19 65.68 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.65 1.567 . . . . 10.0 110.679 174.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -65.58 104.91 0.7 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.38 2.72 . . . . 10.0 110.155 -179.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 110.7 22.44 6.35 Favored Glycine 0 CA--C 1.525 0.7 0 CA-C-O 118.813 -0.993 . . . . 10.0 113.093 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 50.77 33.28 27.14 Favored Glycine 0 CA--C 1.535 1.286 0 CA-C-N 119.222 1.511 . . . . 10.0 114.477 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 6.0 ttm 60.2 29.87 19.37 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.866 1.667 . . . . 10.0 112.764 -176.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.6 -177.91 3.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.576 1.95 . . . . 10.0 110.171 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.5 t -145.99 -67.62 0.29 Allowed 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.582 -0.699 . . . . 10.0 110.72 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -105.41 31.22 5.08 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.671 1.188 . . . . 10.0 110.899 -176.113 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 64.8 m -88.92 114.07 25.15 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.768 1.227 . . . . 10.0 111.017 -172.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.4 p -86.3 151.18 23.8 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.433 0.693 . . . . 10.0 110.359 -174.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.79 -35.48 10.12 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 114.059 1.133 . . . . 10.0 114.059 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -49.28 -55.76 11.67 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.537 0.608 . . . . 10.0 111.348 171.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -76.29 -37.01 58.08 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.543 -0.723 . . . . 10.0 110.928 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -52.95 63.14 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 122.043 0.925 . . . . 10.0 111.115 -179.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.4 mmmm -64.87 -46.42 81.88 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 124.961 1.305 . . . . 10.0 108.96 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.94 -34.85 60.82 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 174.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.32 -43.5 70.16 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.644 -1.285 . . . . 10.0 111.279 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.23 -44.71 96.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 123.713 0.805 . . . . 10.0 112.051 169.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -76.1 -28.07 57.4 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.763 -1.211 . . . . 10.0 111.681 -175.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -46.87 -50.0 19.35 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.818 0.818 . . . . 10.0 110.716 170.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 72.2 mtm -68.46 -47.78 66.23 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.394 -0.821 . . . . 10.0 111.513 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 t -163.92 -87.41 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.353 0.661 . . . . 10.0 111.298 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt 172.43 53.15 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.825 2.05 . . . . 10.0 110.433 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.55 -85.27 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 114.025 1.12 . . . . 10.0 114.025 176.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.422 ' HE2' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.612 1.565 . . . . 10.0 115.072 -173.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.041 0 CA-C-O 118.452 -0.785 . . . . 10.0 110.117 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -163.2 126.79 2.81 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 123.847 0.717 . . . . 10.0 110.473 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -78.82 60.91 2.94 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.664 1.186 . . . . 10.0 109.984 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -111.95 -25.1 9.57 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 125.95 1.7 . . . . 10.0 112.621 173.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -148.91 116.66 6.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.667 0.746 . . . . 10.0 110.207 176.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.41 -33.06 19.44 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 113.139 0.792 . . . . 10.0 113.139 171.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -55.26 -50.61 69.03 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 118.29 0.496 . . . . 10.0 110.906 169.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.85 -34.21 75.08 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.296 0.638 . . . . 10.0 110.785 -177.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.2 mm -65.57 -51.84 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 118.47 -0.776 . . . . 10.0 109.381 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -68.35 -40.47 81.52 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 120.211 1.369 . . . . 10.0 111.249 -178.465 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -68.68 -22.25 64.38 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.461 1.504 . . . . 10.0 112.615 -178.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.49 -29.54 16.94 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.038 -1.039 . . . . 10.0 113.502 167.294 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -106.62 -66.34 1.02 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.742 1.217 . . . . 10.0 112.442 -168.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -78.67 41.1 0.4 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.962 1.705 . . . . 10.0 109.771 179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.8 t -123.21 4.09 9.21 Favored 'General case' 0 N--CA 1.461 0.084 0 C-N-CA 124.485 1.114 . . . . 10.0 112.997 -166.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.7 t -107.0 -53.68 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 C-N-CA 125.097 1.359 . . . . 10.0 108.676 -173.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.6 m -81.43 -62.18 1.73 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.609 1.163 . . . . 10.0 111.629 174.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -73.59 -19.34 60.9 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.967 1.307 . . . . 10.0 114.097 -164.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 t -64.92 -46.5 81.4 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.731 0.812 . . . . 10.0 111.032 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.8 mmt -104.56 -27.28 11.97 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.277 1.431 . . . . 10.0 111.88 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.38 52.8 1.8 Allowed Glycine 0 CA--C 1.533 1.174 0 C-N-CA 124.845 1.212 . . . . 10.0 112.156 -176.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 40.9 t -96.11 161.33 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.75 1.22 . . . . 10.0 109.786 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.23 16.89 5.25 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.083 1.353 . . . . 10.0 113.755 -176.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 74.95 25.52 69.05 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 123.858 0.742 . . . . 10.0 112.843 -172.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.25 141.56 91.53 Favored Pre-proline 0 CA--C 1.537 0.468 0 CA-C-N 118.384 1.092 . . . . 10.0 112.846 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -68.66 145.24 62.97 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 124.08 3.186 . . . . 10.0 110.754 177.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.6 mtpt -73.75 143.39 46.11 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.116 0.413 . . . . 10.0 112.116 -168.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.9 p -57.37 -26.03 60.39 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.119 0.968 . . . . 10.0 113.222 175.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -132.91 105.73 7.28 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.139 0.976 . . . . 10.0 109.338 171.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -147.09 157.98 43.79 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 106.898 -1.519 . . . . 10.0 106.898 173.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.1 t -104.31 -36.09 7.73 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.03 0.377 . . . . 10.0 110.876 166.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.03 -19.19 52.09 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.313 -1.492 . . . . 10.0 113.97 -176.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -89.75 -23.0 21.9 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.654 1.582 . . . . 10.0 110.398 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.515 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 49.4 m95 -97.82 -32.51 11.67 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.834 1.254 . . . . 10.0 110.591 178.215 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -44.14 -58.17 5.25 Favored Pre-proline 0 CA--C 1.542 0.646 0 N-CA-C 114.615 1.339 . . . . 10.0 114.615 172.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.47 6.85 2.1 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.685 2.257 . . . . 10.0 113.612 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -110.8 -42.51 4.0 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.866 1.666 . . . . 10.0 108.777 178.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.18 2.18 1.26 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.465 1.906 . . . . 10.0 114.232 170.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.0 14.57 28.7 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.539 1.136 . . . . 10.0 110.61 177.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 24.9 mmtt -125.42 -61.96 1.24 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.104 1.362 . . . . 10.0 110.606 173.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.422 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 172.09 -125.44 1.18 Allowed Glycine 0 CA--C 1.53 0.994 0 N-CA-C 110.321 -1.111 . . . . 10.0 110.321 -177.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.434 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -146.81 -55.74 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.299 0 C-N-CA 123.992 0.917 . . . . 10.0 110.6 -179.103 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.13 26.62 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.303 1.441 . . . . 10.0 113.995 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.434 ' H ' ' C ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -102.78 -49.21 3.87 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.318 1.847 . . . . 10.0 107.208 177.527 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.6 mp -80.18 -35.05 36.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.634 -172.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.1 p -59.06 -23.76 25.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 124.841 1.257 . . . . 10.0 112.362 171.113 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -78.88 -44.89 21.84 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.359 -0.838 . . . . 10.0 111.321 171.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.22 -42.05 99.21 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.47 -0.769 . . . . 10.0 110.285 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 9.0 p -64.33 -48.2 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 122.901 0.48 . . . . 10.0 110.845 -179.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -33.96 76.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.981 0.42 . . . . 10.0 110.325 177.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.0 m -73.41 -28.94 62.27 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.867 0.691 . . . . 10.0 112.867 175.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.79 119.43 1.42 Allowed Glycine 0 CA--C 1.529 0.918 0 CA-C-N 119.271 0.941 . . . . 10.0 111.126 -172.412 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.8 tp -78.49 -146.09 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 123.918 0.887 . . . . 10.0 110.241 171.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -82.11 -64.06 1.26 Allowed 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.003 -1.686 . . . . 10.0 111.048 -175.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.84 -7.86 56.26 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.677 1.191 . . . . 10.0 112.521 174.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.5 mtp -97.05 135.34 22.02 Favored Pre-proline 0 CA--C 1.538 0.501 0 N-CA-C 113.073 0.768 . . . . 10.0 113.073 178.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.03 157.09 55.16 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.189 1.926 . . . . 10.0 110.635 175.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.54 101.83 0.46 Allowed 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.233 2.622 . . . . 10.0 109.989 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 118.7 -0.15 15.51 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 123.681 0.658 . . . . 10.0 112.909 -172.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 75.71 -48.51 2.29 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 118.78 1.29 . . . . 10.0 112.667 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -174.44 -37.21 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.995 2.118 . . . . 10.0 111.366 166.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -79.25 177.44 8.83 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.947 0.721 . . . . 10.0 112.947 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 t -128.1 -60.67 1.13 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.998 1.319 . . . . 10.0 111.215 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.35 54.01 1.92 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.586 1.154 . . . . 10.0 111.393 -177.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 18.8 m -110.03 125.72 53.22 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.452 1.501 . . . . 10.0 111.372 -177.829 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 30.2 m -112.89 137.13 51.72 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.86 1.264 . . . . 10.0 109.776 -177.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -35.31 -46.18 0.35 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.775 2.03 . . . . 10.0 114.055 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -28.92 -64.29 0.1 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.341 1.856 . . . . 10.0 112.733 165.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -90.17 -34.19 15.94 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.284 0.633 . . . . 10.0 111.724 177.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.58 -44.69 56.91 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 120.707 -1.246 . . . . 10.0 112.487 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.16 -48.17 53.37 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.639 0.776 . . . . 10.0 110.6 174.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.2 -30.6 7.19 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.473 0.545 . . . . 10.0 112.473 172.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.97 -34.36 57.58 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.539 1.136 . . . . 10.0 111.53 -178.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -75.0 -52.87 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.519 1.128 . . . . 10.0 110.115 175.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -64.87 -25.71 68.01 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.513 0.725 . . . . 10.0 112.665 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -40.45 -48.08 2.71 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 121.75 0.786 . . . . 10.0 112.085 169.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.8 mpp? -74.68 -49.34 21.66 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.489 -0.778 . . . . 10.0 112.539 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.446 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 5.5 t -152.72 -89.91 0.05 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.787 -0.625 . . . . 10.0 110.208 175.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 169.17 54.96 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.812 1.645 . . . . 10.0 110.001 -176.039 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -167.22 -87.72 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.328 1.051 . . . . 10.0 113.08 173.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.515 ' HE3' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.285 -0.864 . . . . 10.0 112.414 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.271 0 N-CA-C 114.394 1.257 . . . . 10.0 114.394 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -164.06 82.68 0.43 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.255 0.934 . . . . 10.0 111.46 -173.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -77.18 36.11 0.18 Allowed 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.274 1.213 . . . . 10.0 114.274 -176.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -99.46 -26.41 14.13 Favored 'General case' 0 C--N 1.333 -0.127 0 O-C-N 121.676 -0.64 . . . . 10.0 112.028 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -139.66 120.36 14.29 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 121.533 0.683 . . . . 10.0 109.463 171.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.24 -36.32 30.6 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.723 0.809 . . . . 10.0 113.089 171.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -59.64 -45.67 91.31 Favored 'General case' 0 C--N 1.343 0.309 0 O-C-N 121.972 -0.455 . . . . 10.0 110.622 171.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.05 -31.97 72.0 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.53 -0.731 . . . . 10.0 111.05 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.2 mm -65.32 -51.78 60.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 O-C-N 121.397 -0.814 . . . . 10.0 108.904 175.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.413 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.15 -42.28 76.18 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 117.87 -1.532 . . . . 10.0 111.905 -178.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.83 -22.0 64.26 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.466 1.506 . . . . 10.0 112.443 -177.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -92.04 -29.1 16.76 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.829 1.048 . . . . 10.0 113.829 168.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.91 -64.93 1.22 Allowed 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.218 1.007 . . . . 10.0 112.394 -170.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.413 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.56 40.63 0.18 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.222 1.409 . . . . 10.0 111.232 178.429 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.4 t -126.9 -4.09 6.4 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 124.805 1.242 . . . . 10.0 114.101 -165.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.4 t -97.29 -40.58 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-O 122.456 1.122 . . . . 10.0 108.426 -175.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.3 m -104.06 -61.09 1.48 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 126.765 2.026 . . . . 10.0 109.631 -173.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -74.27 -16.7 60.94 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.537 1.31 . . . . 10.0 114.537 -169.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.0 m -69.81 -44.91 69.05 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.692 0.797 . . . . 10.0 110.893 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 tpt -115.05 -30.66 6.29 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.318 1.047 . . . . 10.0 113.039 -175.433 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.38 61.4 1.81 Allowed Glycine 0 CA--C 1.535 1.342 0 C-N-CA 125.533 1.539 . . . . 10.0 113.183 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 67.2 t -81.8 -57.13 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.951 -0.735 . . . . 10.0 112.056 -175.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.75 35.4 0.51 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.066 0.947 . . . . 10.0 110.725 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 58.64 27.35 61.24 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 124.686 1.136 . . . . 10.0 113.094 -173.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.52 138.19 96.77 Favored Pre-proline 0 CA--C 1.547 0.863 0 O-C-N 122.042 -0.681 . . . . 10.0 111.943 -177.024 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -68.67 149.7 73.81 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 123.35 2.7 . . . . 10.0 111.025 -174.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -70.29 137.6 50.84 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.212 -0.93 . . . . 10.0 112.374 -161.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.4 m -51.53 -25.48 6.74 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.263 1.209 . . . . 10.0 114.263 172.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 -142.5 91.14 2.29 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.637 0.775 . . . . 10.0 110.632 174.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -128.07 171.15 12.14 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.64 1.176 . . . . 10.0 109.166 170.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.6 m -105.36 -33.28 8.23 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 119.37 -0.348 . . . . 10.0 110.925 163.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.91 -38.66 61.77 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.904 -1.122 . . . . 10.0 113.852 -176.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -66.79 -31.02 71.38 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.744 0.783 . . . . 10.0 110.072 177.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.458 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 64.4 m95 -91.79 -34.42 14.59 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.33 2.252 . . . . 10.0 111.982 -171.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -41.16 -61.98 1.17 Allowed Pre-proline 0 CA--C 1.546 0.816 0 N-CA-C 114.094 1.146 . . . . 10.0 114.094 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -71.26 8.79 1.02 Allowed 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 123.08 2.52 . . . . 10.0 114.006 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -113.36 -51.45 2.81 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.019 1.728 . . . . 10.0 108.448 -178.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -21.8 66.65 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.601 1.96 . . . . 10.0 112.053 173.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -79.64 -27.96 40.9 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.153 0.981 . . . . 10.0 110.057 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -76.41 -54.45 6.72 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.226 0.61 . . . . 10.0 109.936 174.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.449 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 162.5 -113.61 0.57 Allowed Glycine 0 CA--C 1.53 0.997 0 N-CA-C 111.167 -0.773 . . . . 10.0 111.167 176.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.428 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.1 OUTLIER -144.09 -57.97 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.31 0 C-N-CA 124.201 1.0 . . . . 10.0 110.572 176.743 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.89 6.73 0.15 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.007 1.723 . . . . 10.0 113.537 -174.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.449 HD22 ' N ' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -93.34 -17.87 23.07 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 125.467 1.507 . . . . 10.0 110.702 -178.459 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -106.4 -40.78 5.49 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.907 0.883 . . . . 10.0 110.949 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.9 p -52.16 -35.0 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 CA-C-O 121.087 0.47 . . . . 10.0 110.532 170.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.6 ptmt -62.28 -46.36 89.14 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.815 1.043 . . . . 10.0 113.815 171.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 64.0 m -67.09 -32.56 73.79 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 120.886 -1.134 . . . . 10.0 110.287 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.3 t -58.15 -58.02 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 122.839 0.456 . . . . 10.0 111.004 172.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -31.47 63.79 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.73 0.641 . . . . 10.0 112.73 175.892 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.71 -32.07 67.39 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 122.848 0.459 . . . . 10.0 112.097 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 79.13 94.4 0.31 Allowed Glycine 0 CA--C 1.532 1.117 0 N-CA-C 111.473 -0.651 . . . . 10.0 111.473 -174.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.5 tp -63.17 168.85 3.89 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.854 -0.792 . . . . 10.0 111.355 175.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -48.56 -57.64 5.88 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.953 -1.092 . . . . 10.0 113.043 -171.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.15 21.48 8.82 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.421 1.488 . . . . 10.0 112.473 174.66 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 39.3 ttp -126.71 129.64 24.02 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 114.313 1.227 . . . . 10.0 114.313 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -63.15 158.03 46.31 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.481 2.121 . . . . 10.0 112.155 177.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -58.96 135.71 68.5 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.703 2.269 . . . . 10.0 110.263 -179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.38 16.11 64.54 Favored Glycine 0 CA--C 1.527 0.841 0 O-C-N 121.742 -0.599 . . . . 10.0 113.872 -174.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 55.63 34.59 60.65 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 118.523 1.162 . . . . 10.0 112.285 -176.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 77.58 44.97 0.08 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.367 1.867 . . . . 10.0 112.529 -176.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.2 t -100.46 152.03 20.85 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.095 1.358 . . . . 10.0 110.901 171.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.5 p -108.78 -88.14 0.49 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.315 1.046 . . . . 10.0 110.132 164.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -106.14 74.93 1.07 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 126.53 1.932 . . . . 10.0 108.1 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -124.61 139.59 53.73 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.464 1.106 . . . . 10.0 110.514 174.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 93.6 m -111.43 153.16 26.51 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.845 1.258 . . . . 10.0 110.148 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -34.45 -45.02 0.21 Allowed 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 127.332 2.253 . . . . 10.0 114.54 176.272 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -41.19 -56.88 2.25 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 119.317 0.962 . . . . 10.0 113.518 170.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.12 -42.73 22.98 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.005 1.322 . . . . 10.0 112.739 175.699 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -55.25 -47.56 75.26 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.073 -1.017 . . . . 10.0 112.05 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 ptmm? -68.58 -52.21 34.24 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 108.442 -0.948 . . . . 10.0 108.442 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.75 -34.55 39.88 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.119 0.567 . . . . 10.0 112.36 177.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -64.2 -50.14 69.26 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.827 0.851 . . . . 10.0 109.811 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 8.9 mt -62.24 -44.15 98.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.181 0.993 . . . . 10.0 111.921 172.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -57.1 -37.92 72.62 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.303 1.441 . . . . 10.0 111.91 175.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -49.47 -43.41 45.04 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.476 0.547 . . . . 10.0 112.476 177.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.458 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -73.29 -69.83 0.4 Allowed 'General case' 0 CA--C 1.537 0.479 0 O-C-N 122.163 -0.336 . . . . 10.0 111.078 179.702 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.1 t -167.27 46.67 0.06 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.625 0.77 . . . . 10.0 111.807 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 37.88 60.71 1.15 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.471 1.508 . . . . 10.0 114.125 175.298 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -162.31 -82.0 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 113.232 0.827 . . . . 10.0 113.232 177.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.434 ' O ' ' NZ ' ' A' ' 78' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.13 0 N-CA-C 114.74 1.385 . . . . 10.0 114.74 -173.149 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.992 0 CA-C-O 118.008 -0.996 . . . . 10.0 110.281 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -160.87 27.71 0.15 Allowed 'General case' 0 CA--C 1.548 0.89 0 CA-C-O 122.647 1.213 . . . . 10.0 110.475 176.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -93.15 62.65 3.56 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 107.955 -1.128 . . . . 10.0 107.955 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -111.8 -26.31 9.02 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.139 0.975 . . . . 10.0 113.514 173.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -151.49 115.16 4.88 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.526 0.731 . . . . 10.0 109.415 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -38.42 -43.77 0.86 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.943 1.697 . . . . 10.0 113.749 167.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -60.84 -48.08 83.43 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 117.983 0.356 . . . . 10.0 111.1 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.61 -30.89 71.28 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.509 -0.744 . . . . 10.0 110.461 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -65.63 -52.72 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-O 118.916 -0.564 . . . . 10.0 109.534 176.185 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.15 -40.48 78.17 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 118.161 -1.416 . . . . 10.0 110.858 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -68.66 -21.93 64.42 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.85 1.66 . . . . 10.0 112.738 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.82 -27.25 14.01 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 113.447 0.906 . . . . 10.0 113.447 168.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -103.46 -67.73 0.87 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.198 0.999 . . . . 10.0 112.409 -174.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.54 38.73 0.19 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.276 1.43 . . . . 10.0 111.001 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -120.39 -4.67 9.89 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 124.669 1.188 . . . . 10.0 113.782 -166.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.3 t -100.09 -40.95 8.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.346 1.058 . . . . 10.0 109.167 -169.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 m -99.46 -61.26 1.39 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.292 2.237 . . . . 10.0 110.903 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -73.44 -22.78 60.11 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.181 0.993 . . . . 10.0 113.542 -167.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.4 t -61.63 -52.48 64.17 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.573 0.749 . . . . 10.0 110.989 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -101.42 -22.38 14.57 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.328 1.051 . . . . 10.0 111.775 -179.213 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.04 52.78 2.67 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.702 1.144 . . . . 10.0 111.956 -175.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 59.7 t -96.68 160.18 2.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 125.262 1.425 . . . . 10.0 109.494 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 60.68 18.6 8.66 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.197 0.999 . . . . 10.0 113.486 -176.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 82.12 3.89 90.42 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 124.082 0.849 . . . . 10.0 113.444 -173.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.49 146.28 64.86 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-N 118.164 0.982 . . . . 10.0 113.394 -174.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -70.5 155.33 63.71 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 123.73 2.954 . . . . 10.0 109.723 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -68.95 139.68 55.06 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 119.825 -0.75 . . . . 10.0 111.573 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -32.24 -45.34 0.11 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.848 2.059 . . . . 10.0 113.45 169.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -139.28 102.14 4.42 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.004 0.922 . . . . 10.0 109.191 170.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -118.03 157.92 25.93 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.059 -1.46 . . . . 10.0 107.059 170.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 92.9 m -103.79 -35.49 8.18 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.519 0.6 . . . . 10.0 111.279 171.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.82 -23.64 36.35 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.102 -0.999 . . . . 10.0 113.269 -178.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.411 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 33.0 t0 -87.62 -22.3 24.82 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.072 1.749 . . . . 10.0 110.517 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -95.39 -35.59 11.68 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.06 1.744 . . . . 10.0 110.803 177.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -40.14 -59.54 1.8 Allowed Pre-proline 0 N--CA 1.476 0.825 0 N-CA-C 114.248 1.203 . . . . 10.0 114.248 170.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.05 17.51 0.33 Allowed 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 123.379 2.719 . . . . 10.0 113.925 -179.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.83 -43.49 2.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.426 1.89 . . . . 10.0 110.336 168.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.1 -13.02 5.73 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.536 1.934 . . . . 10.0 112.488 174.052 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.62 24.18 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.586 1.155 . . . . 10.0 110.513 176.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -77.01 -52.21 9.74 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.144 -0.688 . . . . 10.0 109.144 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.42 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 157.66 -116.61 0.73 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.545 1.069 . . . . 10.0 110.594 175.275 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.463 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -149.02 -55.82 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.314 1.046 . . . . 10.0 110.331 174.63 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -71.76 28.88 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.265 1.026 . . . . 10.0 113.515 -177.113 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.463 ' H ' ' C ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -101.53 -56.3 2.33 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 128.053 2.541 . . . . 10.0 107.217 176.607 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.65 -26.41 32.18 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.71 -0.662 . . . . 10.0 111.161 -172.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -57.17 -22.6 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 125.578 1.551 . . . . 10.0 111.767 166.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.9 mmpt? -80.62 -38.27 29.56 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.227 0.611 . . . . 10.0 111.728 169.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.84 -37.7 64.75 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 120.471 -1.393 . . . . 10.0 110.874 -176.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 10.7 p -61.79 -42.46 94.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.246 1.018 . . . . 10.0 110.544 173.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -35.81 76.71 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.143 0.497 . . . . 10.0 109.683 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 28.0 m -73.05 -34.34 66.22 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.153 -0.967 . . . . 10.0 111.88 177.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.54 115.65 3.72 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.457 -1.057 . . . . 10.0 110.457 -168.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.02 -152.9 0.06 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 167.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -81.51 -60.69 2.17 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.652 -1.28 . . . . 10.0 110.428 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.09 -7.21 59.2 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.448 1.499 . . . . 10.0 112.335 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.72 142.59 25.3 Favored Pre-proline 0 N--CA 1.468 0.442 0 N-CA-C 112.236 0.458 . . . . 10.0 112.236 177.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.66 148.0 71.04 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.376 2.051 . . . . 10.0 110.753 175.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -66.67 110.22 1.83 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.216 2.611 . . . . 10.0 109.825 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 91.52 35.9 6.74 Favored Glycine 0 C--N 1.338 0.688 0 CA-C-O 119.617 -0.546 . . . . 10.0 111.872 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 28.94 39.38 0.02 OUTLIER Glycine 0 CA--C 1.535 1.33 0 C-N-CA 127.365 2.412 . . . . 10.0 115.661 -172.049 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 62.83 -0.85 0.52 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.844 2.057 . . . . 10.0 115.793 -174.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.6 p -94.02 -29.07 15.4 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.608 1.163 . . . . 10.0 112.541 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 96.7 m 65.54 -71.34 0.08 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.149 1.38 . . . . 10.0 111.97 -178.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -79.63 54.52 1.81 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.22 1.408 . . . . 10.0 109.962 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -94.0 117.28 29.89 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.637 1.175 . . . . 10.0 109.307 -174.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 90.9 m -116.34 129.1 56.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.029 -1.101 . . . . 10.0 108.029 -174.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -37.39 -41.45 0.43 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.93 1.692 . . . . 10.0 112.533 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -35.42 -57.36 0.61 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 114.245 1.202 . . . . 10.0 114.245 169.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -91.94 -34.98 14.26 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.188 0.904 . . . . 10.0 111.25 173.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.95 -42.2 85.66 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.5 -1.375 . . . . 10.0 112.559 -170.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -42.73 99.9 Favored 'General case' 0 C--O 1.222 -0.35 0 O-C-N 121.353 -0.842 . . . . 10.0 109.909 174.395 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.39 -28.8 69.52 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.351 1.06 . . . . 10.0 111.999 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.64 -46.38 38.58 Favored 'General case' 0 C--O 1.223 -0.341 0 O-C-N 121.007 -1.058 . . . . 10.0 109.604 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -61.45 -46.65 96.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 121.514 0.673 . . . . 10.0 111.407 170.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . 0.256 0.0 OUTLIER -59.63 -35.38 74.26 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 121.491 -0.756 . . . . 10.0 112.185 -177.866 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -44.61 -41.14 6.36 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.34 0.867 . . . . 10.0 113.34 178.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.72 -67.5 0.69 Allowed 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.113 -0.367 . . . . 10.0 111.713 -177.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.0 t -164.07 33.81 0.08 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.696 0.798 . . . . 10.0 112.479 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt 38.23 61.27 1.14 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.863 1.265 . . . . 10.0 114.172 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -149.49 -55.57 0.18 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.073 0.949 . . . . 10.0 112.806 -178.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.411 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.2 0 C-N-CA 125.97 1.708 . . . . 10.0 112.134 -171.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.017 0 CA-C-O 117.399 -1.286 . . . . 10.0 109.359 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -161.38 91.52 0.85 Allowed 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 108.605 -0.887 . . . . 10.0 108.605 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -144.68 30.74 1.19 Allowed 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 113.34 0.867 . . . . 10.0 113.34 -174.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -96.85 -21.42 17.51 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.619 0.768 . . . . 10.0 112.14 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -139.87 121.53 15.3 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 124.697 1.199 . . . . 10.0 107.996 172.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -44.84 -41.0 6.68 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.114 1.366 . . . . 10.0 113.363 168.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -59.51 -47.27 86.15 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.053 -0.405 . . . . 10.0 110.901 171.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.17 -31.3 70.76 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.705 -0.622 . . . . 10.0 111.123 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.3 mt -64.44 -53.12 46.66 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 N-CA-C 107.981 -1.118 . . . . 10.0 107.981 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.69 -41.58 75.24 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 117.836 -1.545 . . . . 10.0 112.085 -177.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.78 -21.8 64.32 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.299 1.839 . . . . 10.0 112.566 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.65 -28.56 15.29 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.291 0.848 . . . . 10.0 113.291 168.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -108.05 -64.67 1.19 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.173 0.989 . . . . 10.0 112.652 -170.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.1 41.74 0.3 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.911 1.285 . . . . 10.0 110.552 178.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.2 t -126.82 4.04 6.65 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.556 1.142 . . . . 10.0 113.507 -165.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.9 t -109.75 -53.76 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 C-N-CA 125.175 1.39 . . . . 10.0 108.676 -172.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.9 m -79.31 -64.31 1.22 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.856 1.262 . . . . 10.0 110.422 173.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -73.81 -10.39 59.62 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.152 1.781 . . . . 10.0 115.058 -165.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 t -72.01 -48.18 46.57 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.92 0.488 . . . . 10.0 109.968 178.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.3 tpt -106.59 -41.07 5.36 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.155 0.982 . . . . 10.0 112.439 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 96.25 62.47 0.96 Allowed Glycine 0 CA--C 1.536 1.376 0 C-N-CA 125.495 1.522 . . . . 10.0 112.666 -175.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 95.3 t -82.41 -55.99 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 O-C-N 121.854 -0.792 . . . . 10.0 112.027 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.94 32.92 0.43 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.064 0.946 . . . . 10.0 111.079 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 66.33 16.66 65.21 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 124.635 1.112 . . . . 10.0 113.442 -173.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.29 141.46 96.23 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 113.4 0.889 . . . . 10.0 113.4 -174.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.58 138.56 38.68 Favored 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 124.764 3.642 . . . . 10.0 110.717 -176.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.4 mttm -69.32 138.54 53.86 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 121.715 -0.616 . . . . 10.0 111.157 -168.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.6 t -47.46 -36.95 10.8 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.076 0.769 . . . . 10.0 113.076 175.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -119.8 73.72 0.98 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.646 1.578 . . . . 10.0 111.889 179.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -117.74 159.8 22.4 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.046 -1.034 . . . . 10.0 109.757 171.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 57.6 m -108.33 -35.9 6.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.5 0.32 . . . . 10.0 111.39 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.01 -23.32 31.01 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 121.699 -0.625 . . . . 10.0 112.363 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -80.19 -33.86 37.88 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.859 1.663 . . . . 10.0 109.769 178.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.484 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 58.4 m95 -86.41 -35.33 19.8 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.039 1.736 . . . . 10.0 111.772 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -39.61 -59.69 1.56 Allowed Pre-proline 0 CA--C 1.548 0.887 0 O-C-N 120.272 -1.518 . . . . 10.0 114.762 172.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -75.06 15.46 0.74 Allowed 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.617 2.878 . . . . 10.0 113.528 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.425 ' C ' ' H ' ' A' ' 36' ' ' ALA . 0.6 OUTLIER -116.57 -45.45 2.8 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.531 1.932 . . . . 10.0 108.176 177.609 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.3 mt -58.18 0.35 0.07 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 127.623 2.369 . . . . 10.0 114.208 168.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.425 ' H ' ' C ' ' A' ' 34' ' ' ARG . . . -84.04 -29.12 27.14 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.218 1.407 . . . . 10.0 110.076 177.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -94.61 -64.68 1.05 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.865 0.866 . . . . 10.0 109.359 -179.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 129.51 119.97 2.2 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 124.184 0.897 . . . . 10.0 112.127 171.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.6 m -38.59 116.06 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 114.214 1.19 . . . . 10.0 114.214 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 138.23 -19.99 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 130.142 3.377 . . . . 10.0 110.819 -169.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.09 -57.51 3.75 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.436 1.017 . . . . 10.0 109.985 172.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.2 mp -76.7 -24.06 53.12 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.52 -0.737 . . . . 10.0 111.76 -168.306 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -60.15 -27.37 38.99 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 O-C-N 121.686 -0.634 . . . . 10.0 110.829 170.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.9 mmpt? -67.53 -45.84 74.56 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.347 -0.845 . . . . 10.0 110.761 171.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.9 m -62.08 -36.57 82.08 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.174 -0.953 . . . . 10.0 110.155 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.2 t -58.84 -54.13 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 121.065 0.46 . . . . 10.0 111.177 175.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -33.92 71.67 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.325 0.491 . . . . 10.0 112.325 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 58.7 m -71.56 -27.48 63.19 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.696 0.799 . . . . 10.0 112.852 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 76.67 91.93 0.23 Allowed Glycine 0 CA--C 1.53 0.985 0 CA-C-N 119.336 0.971 . . . . 10.0 112.27 -174.19 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.94 167.99 1.43 Allowed 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 122.056 0.932 . . . . 10.0 111.419 171.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.44 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 13.7 m-80 -53.66 -55.3 27.21 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.515 -1.365 . . . . 10.0 112.417 -172.448 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.15 19.93 2.94 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 113.862 -1.517 . . . . 10.0 112.573 174.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.0 ttp -136.15 134.94 20.49 Favored Pre-proline 0 CA--C 1.546 0.802 0 N-CA-C 114.769 1.396 . . . . 10.0 114.769 -175.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.14 147.66 73.48 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 120.965 1.11 . . . . 10.0 111.553 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -61.5 132.61 41.51 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.251 2.634 . . . . 10.0 109.853 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.65 15.05 81.88 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 119.711 -1.233 . . . . 10.0 112.76 -172.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.09 34.63 6.03 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 118.36 1.08 . . . . 10.0 113.728 -177.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 77.18 37.92 0.25 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 126.231 1.812 . . . . 10.0 113.583 -177.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 9.8 t -126.03 164.6 20.5 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.427 1.491 . . . . 10.0 111.65 169.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.0 m -102.88 -64.06 1.11 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.686 1.194 . . . . 10.0 111.62 -178.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -122.56 46.51 2.13 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.893 1.277 . . . . 10.0 110.536 -176.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 5.4 m -71.98 116.02 11.88 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 120.824 -1.173 . . . . 10.0 110.068 172.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 t -85.08 138.85 32.16 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.284 0.634 . . . . 10.0 109.612 172.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -36.73 -40.09 0.25 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.49 1.916 . . . . 10.0 112.46 174.045 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -42.17 -55.17 3.37 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.912 1.285 . . . . 10.0 114.049 170.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -89.45 -33.85 16.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.065 0.546 . . . . 10.0 111.278 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.67 -43.79 65.77 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.417 1.087 . . . . 10.0 111.417 176.672 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -72.45 -45.15 60.88 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.86 1.264 . . . . 10.0 110.159 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -57.68 -33.5 68.41 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.432 -0.793 . . . . 10.0 111.577 174.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.56 -46.66 84.88 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 124.039 0.935 . . . . 10.0 110.561 -176.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 25.0 pt -76.59 -37.99 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 124.061 0.945 . . . . 10.0 112.28 174.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -58.19 -36.74 73.52 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.893 -0.504 . . . . 10.0 112.345 173.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -51.08 -44.96 61.3 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 174.321 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -67.62 -75.01 0.1 Allowed 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.618 0.599 . . . . 10.0 112.618 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -153.75 25.51 0.5 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.11 0.564 . . . . 10.0 111.769 -179.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 34.39 61.35 0.55 Allowed 'General case' 0 C--N 1.339 0.143 0 C-N-CA 126.895 2.078 . . . . 10.0 115.696 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -142.84 -56.76 0.43 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.311 -0.858 . . . . 10.0 112.676 -176.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.484 ' HE3' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.954 0 CA-C-O 116.624 -1.655 . . . . 10.0 112.823 -177.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.095 0 CA-C-O 117.145 -1.407 . . . . 10.0 109.271 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -164.09 128.39 2.71 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.91 1.684 . . . . 10.0 108.082 165.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -139.74 29.89 2.1 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.196 0.813 . . . . 10.0 113.196 165.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -96.83 -20.03 18.46 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 -167.315 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -141.17 131.2 24.61 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.159 -1.052 . . . . 10.0 108.159 166.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -46.29 -40.52 11.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.877 1.271 . . . . 10.0 112.783 169.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -56.24 -50.53 71.05 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.684 0.394 . . . . 10.0 111.008 171.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.15 -32.25 72.4 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.906 -0.496 . . . . 10.0 110.788 -176.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mt -64.69 -52.66 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 108.566 -0.901 . . . . 10.0 108.566 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.431 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.07 -41.58 77.35 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 117.882 -1.527 . . . . 10.0 112.033 -178.419 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -68.91 -22.13 64.18 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.757 1.623 . . . . 10.0 112.608 -176.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.0 tttp -95.77 -28.13 14.91 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.976 0.91 . . . . 10.0 113.35 170.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.5 -65.03 1.18 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.287 1.035 . . . . 10.0 112.318 -171.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.431 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.82 41.43 0.21 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.16 1.384 . . . . 10.0 111.013 178.118 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -125.41 -2.38 7.46 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 114.173 1.175 . . . . 10.0 114.173 -164.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 46.9 t -99.46 -47.99 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 124.574 1.15 . . . . 10.0 108.48 -177.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 89.9 m -95.48 -59.43 1.88 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.696 1.998 . . . . 10.0 110.602 -173.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 -74.44 -17.98 60.7 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 -171.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.2 t -62.84 -49.91 73.01 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 122.99 0.516 . . . . 10.0 110.465 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.3 tpt -102.84 -33.78 9.23 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.633 0.773 . . . . 10.0 112.705 176.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 101.45 56.52 0.86 Allowed Glycine 0 CA--C 1.536 1.382 0 C-N-CA 125.078 1.323 . . . . 10.0 111.572 -170.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 82.4 t -98.97 157.74 3.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.631 1.572 . . . . 10.0 109.703 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.15 24.24 11.09 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.448 1.099 . . . . 10.0 112.894 -175.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.18 5.47 87.3 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.124 0.868 . . . . 10.0 113.497 -174.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.87 145.83 77.86 Favored Pre-proline 0 CA--C 1.538 0.484 0 CA-C-N 118.771 1.286 . . . . 10.0 112.545 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -66.11 163.18 32.49 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 C-N-CA 123.599 2.866 . . . . 10.0 109.192 171.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.0 tttp -84.31 149.24 26.2 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 121.624 0.726 . . . . 10.0 110.908 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.7 p -43.28 -70.02 0.12 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.173 1.789 . . . . 10.0 111.4 170.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -103.48 119.98 39.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.823 1.649 . . . . 10.0 108.133 174.085 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -151.76 167.74 27.28 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 126.24 1.816 . . . . 10.0 108.19 171.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.0 m -110.77 -36.21 5.77 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 170.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.36 -14.03 41.85 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.288 -0.883 . . . . 10.0 113.159 -177.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -87.25 -27.21 23.07 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.515 1.926 . . . . 10.0 110.191 176.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 83.9 m95 -95.66 -38.84 10.19 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.367 1.867 . . . . 10.0 112.017 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -41.7 -57.86 3.62 Favored Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 114.682 1.364 . . . . 10.0 114.682 173.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.12 1.16 4.24 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.331 2.687 . . . . 10.0 113.949 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -102.93 -43.66 5.46 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.12 1.368 . . . . 10.0 109.237 177.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.5 5.31 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.107 1.763 . . . . 10.0 114.757 165.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.14 -30.69 18.42 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.59 1.156 . . . . 10.0 110.32 176.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -91.34 -54.66 3.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.121 0.568 . . . . 10.0 111.218 174.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.432 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 161.34 -123.14 1.18 Allowed Glycine 0 CA--C 1.533 1.186 0 N-CA-C 111.782 -0.527 . . . . 10.0 111.782 178.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.45 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -138.4 -65.54 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.271 1.029 . . . . 10.0 111.75 -177.447 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.7 15.86 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.871 1.668 . . . . 10.0 115.304 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.45 ' H ' ' C ' ' A' ' 39' ' ' VAL . 0.3 OUTLIER -93.03 -48.74 6.36 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.401 1.48 . . . . 10.0 108.661 178.152 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.6 mt -81.03 -33.43 33.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 124.325 1.05 . . . . 10.0 110.13 -168.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.4 p -54.59 -32.43 25.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-O 121.651 0.738 . . . . 10.0 111.627 169.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -64.85 -41.71 95.49 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.645 -0.659 . . . . 10.0 110.892 177.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.0 m -67.69 -34.31 76.65 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.52 -0.738 . . . . 10.0 110.338 174.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.0 t -58.38 -52.51 58.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 O-C-N 121.791 -0.568 . . . . 10.0 111.173 175.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.6 -37.45 70.68 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.187 0.44 . . . . 10.0 112.187 174.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -71.87 -33.66 68.57 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.218 0.607 . . . . 10.0 111.972 -177.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.9 97.54 0.25 Allowed Glycine 0 CA--C 1.535 1.285 0 N-CA-C 111.482 -0.647 . . . . 10.0 111.482 -169.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.8 tt -61.54 167.3 3.51 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.845 -0.797 . . . . 10.0 111.197 173.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.402 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 5.1 m-80 -45.51 -58.89 3.04 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.553 -1.342 . . . . 10.0 113.545 -172.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -93.98 19.36 9.16 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.312 1.445 . . . . 10.0 112.859 175.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 34.9 ttp -125.23 129.09 24.6 Favored Pre-proline 0 CA--C 1.553 1.084 0 N-CA-C 114.116 1.154 . . . . 10.0 114.116 173.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -63.06 158.29 44.52 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.229 1.953 . . . . 10.0 111.864 176.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -60.3 148.16 91.13 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.792 2.328 . . . . 10.0 111.021 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 53.12 31.57 41.21 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-N 115.916 -0.583 . . . . 10.0 113.598 -174.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 42.42 32.45 1.21 Allowed Glycine 0 CA--C 1.543 1.813 0 C-N-CA 124.554 1.073 . . . . 10.0 114.534 -170.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.3 ttm 81.24 27.09 0.2 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.068 2.147 . . . . 10.0 114.896 -176.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.7 t -104.76 165.63 10.94 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 120.857 -1.152 . . . . 10.0 112.172 171.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 29.4 m -100.71 -91.94 0.3 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.788 1.235 . . . . 10.0 109.682 174.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -92.57 46.53 1.25 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.441 1.096 . . . . 10.0 110.7 -173.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.61 115.89 16.78 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.692 -1.255 . . . . 10.0 109.943 175.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 93.7 m -80.16 149.82 30.39 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.514 0.725 . . . . 10.0 109.596 174.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -32.77 -55.74 0.37 Allowed 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.123 1.157 . . . . 10.0 114.123 167.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -48.22 -55.47 10.4 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.501 0.72 . . . . 10.0 111.675 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -73.57 -35.68 65.49 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.854 -0.529 . . . . 10.0 111.473 -177.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -56.94 -50.69 71.83 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.751 0.786 . . . . 10.0 110.987 172.104 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -64.58 -50.59 66.64 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.434 1.494 . . . . 10.0 109.544 -177.036 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.64 -39.67 25.02 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.033 0.533 . . . . 10.0 112.022 169.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.09 -47.71 60.75 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 120.862 -1.149 . . . . 10.0 112.186 177.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mt -55.94 -48.99 77.8 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 C-N-CA 124.85 1.26 . . . . 10.0 111.431 174.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -24.97 58.29 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.94 -1.1 . . . . 10.0 113.195 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -47.03 -50.63 19.12 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 119.152 0.887 . . . . 10.0 111.295 170.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -70.61 -44.33 67.48 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 178.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -154.2 -77.32 0.11 Allowed 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.928 -0.558 . . . . 10.0 112.35 172.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 157.99 58.22 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 128.697 2.799 . . . . 10.0 111.215 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -174.14 -75.96 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.809 1.411 . . . . 10.0 114.809 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.9 pttp . . . . . 0 C--O 1.256 1.415 0 N-CA-C 115.603 1.705 . . . . 10.0 115.603 -174.412 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 118.746 -0.645 . . . . 10.0 110.942 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -161.03 125.73 3.58 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.902 0.881 . . . . 10.0 110.214 -175.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.85 65.14 1.35 Allowed 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 122.168 0.985 . . . . 10.0 111.79 176.021 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.35 -24.14 12.34 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.93 0.715 . . . . 10.0 112.93 -178.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -142.05 124.29 15.54 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 107.302 -1.37 . . . . 10.0 107.302 171.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.98 -37.26 43.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 172.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -55.75 -49.57 72.74 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.648 0.658 . . . . 10.0 109.864 172.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.64 -33.71 74.48 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.866 0.466 . . . . 10.0 111.106 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.91 -51.31 62.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 107.929 -1.137 . . . . 10.0 107.929 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.93 -42.1 77.22 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 119.615 1.098 . . . . 10.0 111.187 -178.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -68.26 -22.23 64.77 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.906 1.282 . . . . 10.0 112.639 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.9 tppt? -93.68 -28.17 16.13 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.485 1.114 . . . . 10.0 113.647 169.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -108.71 -68.87 0.89 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.387 1.475 . . . . 10.0 112.777 -171.079 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.54 45.05 0.38 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.393 1.477 . . . . 10.0 109.683 179.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.9 t -128.7 -5.5 5.18 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 125.388 1.475 . . . . 10.0 113.343 -167.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.1 t -101.91 -34.19 3.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 125.269 1.427 . . . . 10.0 109.171 -173.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.2 m -102.57 -63.31 1.17 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.101 2.16 . . . . 10.0 110.947 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -73.41 -24.9 60.33 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 114.062 1.134 . . . . 10.0 114.062 -162.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -58.59 -50.79 72.52 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.281 1.032 . . . . 10.0 111.339 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.6 tpt -105.07 -17.9 14.34 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.661 0.784 . . . . 10.0 112.073 -178.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.01 50.17 4.0 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 124.191 0.901 . . . . 10.0 112.17 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 47.0 t -95.51 162.17 2.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 125.344 1.458 . . . . 10.0 109.616 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.84 19.29 8.18 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.632 1.173 . . . . 10.0 113.042 -174.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.9 18.17 79.08 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 124.042 0.829 . . . . 10.0 113.003 -173.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.76 148.57 92.54 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 118.52 1.16 . . . . 10.0 112.649 -178.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_endo -76.14 153.3 36.37 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 124.958 3.772 . . . . 10.0 110.272 179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -67.69 144.48 55.45 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.83 -172.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.3 m -34.26 -43.11 0.15 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.898 1.679 . . . . 10.0 113.679 169.129 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -143.61 110.31 5.56 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.661 0.743 . . . . 10.0 109.765 173.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -129.05 162.93 26.53 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 106.44 -1.689 . . . . 10.0 106.44 174.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 90.2 m -106.17 -36.2 6.97 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.756 0.707 . . . . 10.0 111.157 169.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.06 -26.57 59.49 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 120.63 -1.294 . . . . 10.0 112.735 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -90.07 -8.46 51.39 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.864 1.666 . . . . 10.0 110.645 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.402 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 48.5 m95 -110.73 -29.91 7.8 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.699 -1.25 . . . . 10.0 109.884 176.694 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -39.49 -60.58 1.24 Allowed Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 125.496 1.518 . . . . 10.0 114.292 170.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -67.99 2.4 2.65 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.295 1.997 . . . . 10.0 113.898 -177.008 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -113.51 -47.33 3.0 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.246 1.419 . . . . 10.0 110.48 176.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.34 -18.7 63.92 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.731 1.613 . . . . 10.0 112.911 173.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.12 -31.38 61.1 Favored 'General case' 0 N--CA 1.457 -0.104 0 C-N-CA 124.648 1.179 . . . . 10.0 109.588 178.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.1 mmtt -77.79 -56.14 4.75 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.313 171.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.09 -114.25 0.65 Allowed Glycine 0 CA--C 1.531 1.039 0 N-CA-C 111.987 -0.445 . . . . 10.0 111.987 173.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.86 168.16 19.64 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.076 0 C-N-CA 125.567 1.547 . . . . 10.0 109.796 175.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 76.18 -34.04 0.23 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.331 1.452 . . . . 10.0 112.212 -174.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.3 -24.4 54.75 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 120.241 -1.537 . . . . 10.0 114.124 -177.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -105.92 -33.9 7.79 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.461 1.104 . . . . 10.0 111.939 -178.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -56.53 -35.11 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 121.299 -0.876 . . . . 10.0 109.751 170.402 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.13 -42.72 91.29 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.972 1.101 . . . . 10.0 113.972 168.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.9 m -65.9 -39.5 90.66 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 120.688 -1.258 . . . . 10.0 110.442 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 15.6 t -56.31 -51.75 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.49 0.716 . . . . 10.0 110.811 176.604 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -62.95 -33.83 76.2 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.961 0.726 . . . . 10.0 112.961 176.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 85.3 m -72.31 -24.32 61.3 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.211 0.605 . . . . 10.0 112.314 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.28 92.56 0.3 Allowed Glycine 0 CA--C 1.533 1.218 0 CA-C-N 119.298 0.954 . . . . 10.0 112.371 -178.486 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -179.09 1.02 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.215 1.007 . . . . 10.0 111.951 175.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -55.97 -54.84 39.98 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 123.557 1.646 . . . . 10.0 111.243 -163.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.93 20.77 10.59 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 128.002 2.521 . . . . 10.0 111.927 176.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -130.75 128.39 22.44 Favored Pre-proline 0 CA--C 1.545 0.76 0 N-CA-C 113.341 0.867 . . . . 10.0 113.341 -177.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -70.02 157.76 58.81 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 121.497 1.465 . . . . 10.0 111.13 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -63.83 114.11 2.45 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 123.415 2.743 . . . . 10.0 109.846 -177.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 92.61 11.94 58.76 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-O 119.853 -0.415 . . . . 10.0 114.097 -171.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.39 -44.06 2.39 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-N 118.692 1.246 . . . . 10.0 113.486 173.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.26 -47.31 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.793 1.637 . . . . 10.0 111.893 172.252 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.68 159.11 26.82 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.211 1.404 . . . . 10.0 111.673 178.296 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 86.2 m -103.6 -64.17 1.12 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.744 1.218 . . . . 10.0 112.041 175.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -80.92 56.62 2.8 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.967 0.907 . . . . 10.0 110.784 -173.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -101.12 139.72 36.41 Favored 'General case' 0 CA--C 1.527 0.063 0 C-N-CA 124.642 1.177 . . . . 10.0 110.802 -173.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.0 m -110.77 143.93 40.53 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.12 0.968 . . . . 10.0 108.971 -176.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -47.09 -36.89 8.79 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 114.056 1.132 . . . . 10.0 114.056 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -51.33 -52.62 43.82 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.229 0.922 . . . . 10.0 111.78 170.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.76 -46.32 54.02 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.957 0.799 . . . . 10.0 110.635 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -58.99 -51.66 69.11 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 120.838 -1.164 . . . . 10.0 111.424 -179.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -68.01 -45.03 75.17 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 117.673 -1.156 . . . . 10.0 109.271 -177.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.66 -31.3 36.34 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.796 1.18 . . . . 10.0 112.887 169.213 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.74 -36.55 31.89 Favored 'General case' 0 C--O 1.222 -0.342 0 O-C-N 120.694 -1.254 . . . . 10.0 112.1 -177.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.0 mt -74.24 -48.27 37.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 125.154 1.381 . . . . 10.0 111.281 174.015 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -27.75 67.2 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.414 1.086 . . . . 10.0 113.312 175.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 32.4 t80 -46.23 -38.72 8.81 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.666 0.617 . . . . 10.0 112.666 171.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.402 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -87.36 -71.29 0.57 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 122.946 0.498 . . . . 10.0 112.018 -177.356 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.3 t -160.13 36.49 0.17 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.495 0.718 . . . . 10.0 112.312 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.5 ptmm? 33.23 66.55 0.21 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 126.349 1.859 . . . . 10.0 114.796 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -163.17 -49.18 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.141 -0.936 . . . . 10.0 113.356 -178.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.408 ' OXT' ' NZ ' ' A' ' 78' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.72 0 CA-C-O 118.089 -0.958 . . . . 10.0 111.511 179.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . 0.405 ' C3A' ' HE2' ' A' ' 78' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.168 0 N-CA-C 114.008 1.114 . . . . 10.0 114.008 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -164.01 130.03 3.05 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.611 0.764 . . . . 10.0 109.514 -171.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -78.0 54.65 1.34 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.149 0.98 . . . . 10.0 111.326 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -111.23 -22.07 11.58 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.656 1.582 . . . . 10.0 112.931 -178.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -151.87 121.07 6.73 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.191 0.996 . . . . 10.0 109.782 -174.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -42.83 -44.39 4.45 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.132 1.373 . . . . 10.0 113.693 170.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -55.96 -50.99 69.25 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.94 0.4 . . . . 10.0 110.312 175.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.33 -31.83 70.54 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.775 -0.578 . . . . 10.0 111.27 -176.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mt -67.59 -51.94 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.24 -41.68 76.64 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 119.077 -1.049 . . . . 10.0 111.025 178.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -67.15 -21.42 65.82 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.315 1.446 . . . . 10.0 112.161 -177.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.41 -27.53 18.26 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.445 1.276 . . . . 10.0 114.445 166.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.69 -70.7 0.8 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.796 1.238 . . . . 10.0 111.582 -168.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.98 38.69 0.17 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.115 1.766 . . . . 10.0 110.224 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.9 t -119.26 -6.13 10.38 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 125.301 1.44 . . . . 10.0 113.833 -167.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.7 t -93.86 -38.06 9.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-O 122.322 1.058 . . . . 10.0 108.304 -175.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.6 m -110.83 -60.18 1.86 Allowed 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 126.474 1.909 . . . . 10.0 109.507 -167.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -74.49 -26.12 59.81 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 114.061 1.134 . . . . 10.0 114.061 -170.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 t -58.55 -55.0 40.72 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.966 0.906 . . . . 10.0 110.916 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.8 mmt -101.07 -23.87 14.41 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.645 1.178 . . . . 10.0 112.06 -178.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.64 52.93 2.7 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 124.92 1.248 . . . . 10.0 112.08 -174.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.7 t -93.25 156.17 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 125.389 1.475 . . . . 10.0 109.525 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.78 25.05 11.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.263 1.025 . . . . 10.0 113.106 -176.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.06 12.05 83.62 Favored Glycine 0 CA--C 1.535 1.306 0 C-N-CA 123.83 0.729 . . . . 10.0 113.206 -175.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.14 152.31 72.2 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 118.289 1.044 . . . . 10.0 111.995 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.26 169.51 21.85 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.739 2.959 . . . . 10.0 110.538 -177.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -78.07 146.68 35.11 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.634 -0.666 . . . . 10.0 112.382 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.17 -30.32 6.66 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.093 1.357 . . . . 10.0 113.976 168.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.6 p80 -146.44 114.92 6.75 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.045 -1.034 . . . . 10.0 110.006 174.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.424 HD21 ' CG ' ' A' ' 30' ' ' ASP . 5.3 m-20 -144.54 168.47 20.08 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.782 -1.192 . . . . 10.0 107.782 174.297 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 97.5 m -109.61 -32.38 7.13 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 119.294 -0.384 . . . . 10.0 110.955 167.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.57 -28.4 45.88 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 114.6 1.333 . . . . 10.0 114.6 -175.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.446 ' CB ' ' HZ3' ' A' ' 78' ' ' LYS . 0.7 OUTLIER -81.15 -33.45 33.14 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.908 0.861 . . . . 10.0 109.498 176.061 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.445 ' CE3' ' HB2' ' A' ' 75' ' ' SER . 62.7 m95 -77.7 -41.08 39.21 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.155 0.982 . . . . 10.0 109.997 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -39.92 -65.04 0.46 Allowed Pre-proline 0 CA--C 1.549 0.907 0 CA-C-N 120.627 1.558 . . . . 10.0 114.9 174.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -70.9 -0.65 8.19 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 123.512 2.808 . . . . 10.0 113.495 -178.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.72 -34.67 9.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.311 1.444 . . . . 10.0 109.905 170.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 tp -98.53 20.68 12.38 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 128.228 2.611 . . . . 10.0 111.998 -173.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -106.89 16.29 24.48 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.638 1.575 . . . . 10.0 110.346 174.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -133.2 -45.3 0.84 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 126.434 1.894 . . . . 10.0 110.504 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 163.46 -142.59 7.96 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 109.343 -1.503 . . . . 10.0 109.343 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.414 ' C ' ' H ' ' A' ' 41' ' ' ASN . 3.1 t -129.75 -55.01 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 123.783 0.833 . . . . 10.0 109.737 -177.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.64 32.93 0.08 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.216 1.806 . . . . 10.0 113.294 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.414 ' H ' ' C ' ' A' ' 39' ' ' VAL . 8.2 m-20 -106.06 -46.56 4.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 128.151 2.58 . . . . 10.0 108.044 176.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -83.17 -40.22 19.99 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.016 0.927 . . . . 10.0 111.51 -173.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 p -55.9 -26.6 21.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-O 121.612 0.72 . . . . 10.0 110.523 171.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.3 mmtt -72.6 -37.35 68.15 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.333 -0.854 . . . . 10.0 112.561 173.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.7 m -67.25 -32.98 74.37 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.973 0.892 . . . . 10.0 110.573 174.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.5 t -57.84 -49.33 81.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 O-C-N 121.443 -0.785 . . . . 10.0 111.858 171.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -28.45 69.66 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.062 0.764 . . . . 10.0 113.062 -177.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.0 p -83.59 -29.62 27.62 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.941 0.719 . . . . 10.0 112.941 174.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.0 101.22 0.33 Allowed Glycine 0 CA--C 1.527 0.818 0 CA-C-N 118.663 0.665 . . . . 10.0 112.445 -171.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.27 173.94 1.36 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.437 0.637 . . . . 10.0 111.141 165.22 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.413 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 10.3 m-80 -47.69 -57.88 4.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.439 1.496 . . . . 10.0 114.136 -167.859 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -99.26 23.48 9.15 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.359 1.464 . . . . 10.0 111.264 177.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -112.55 154.99 44.48 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 114.735 1.383 . . . . 10.0 114.735 172.053 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -76.06 134.44 16.1 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 122.782 2.321 . . . . 10.0 110.539 175.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -66.56 117.27 4.6 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.124 2.549 . . . . 10.0 110.288 178.224 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.76 30.91 10.7 Favored Glycine 0 C--N 1.343 0.926 0 C-N-CA 120.102 -1.047 . . . . 10.0 110.546 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.18 38.5 6.41 Favored Glycine 0 CA--C 1.531 1.054 0 CA-C-N 117.728 0.764 . . . . 10.0 114.482 178.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 73.48 -59.51 0.56 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.163 1.385 . . . . 10.0 111.367 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.4 t -82.76 98.31 9.03 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 125.151 1.38 . . . . 10.0 110.798 170.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.1 t -59.91 -42.11 93.16 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.422 169.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -79.41 57.22 2.32 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.036 1.334 . . . . 10.0 111.189 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.9 m -127.97 134.43 49.28 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 126.105 1.762 . . . . 10.0 110.975 -175.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 m -103.75 141.7 35.64 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.772 0.829 . . . . 10.0 109.942 -178.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -44.32 -34.95 2.13 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.028 1.121 . . . . 10.0 114.028 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -45.42 -56.65 4.78 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.502 1.121 . . . . 10.0 110.807 169.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.89 -44.59 26.64 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.434 1.494 . . . . 10.0 108.8 -175.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -47.43 85.65 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.012 1.325 . . . . 10.0 110.542 -174.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.0 mtpm? -69.48 -44.46 71.11 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.526 -0.733 . . . . 10.0 111.144 174.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.59 -27.41 6.75 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 119.288 0.949 . . . . 10.0 112.905 170.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.11 -46.48 11.9 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.139 -0.976 . . . . 10.0 110.656 173.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.2 tp -53.42 -34.94 23.86 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.695 1.198 . . . . 10.0 113.214 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.44 -17.95 29.34 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.288 1.435 . . . . 10.0 113.214 177.37 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -53.05 -44.99 67.85 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.402 -0.811 . . . . 10.0 111.941 174.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.3 mpp? -71.62 -62.19 1.5 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.479 1.112 . . . . 10.0 112.362 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.445 ' HB2' ' CE3' ' A' ' 31' ' ' TRP . 15.4 m -141.66 -93.84 0.14 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.215 1.006 . . . . 10.0 110.056 172.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.8 ptmt -174.89 56.11 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.984 1.313 . . . . 10.0 109.022 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.71 -75.38 0.05 Allowed 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 114.26 1.207 . . . . 10.0 114.26 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.446 ' HZ3' ' CB ' ' A' ' 30' ' ' ASP . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.186 0 N-CA-C 115.761 1.763 . . . . 10.0 115.761 -160.376 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.083 0 CA-C-O 117.79 -1.1 . . . . 10.0 109.445 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -162.18 125.91 3.1 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.955 -0.758 . . . . 10.0 108.955 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.27 69.38 3.54 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.344 1.069 . . . . 10.0 110.088 -178.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.13 -21.64 11.84 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.424 1.489 . . . . 10.0 112.47 171.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -147.22 122.75 10.42 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.433 0.635 . . . . 10.0 109.459 -176.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -45.25 -40.77 7.81 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.794 1.238 . . . . 10.0 113.522 167.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -54.87 -50.82 67.76 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-N 118.117 0.417 . . . . 10.0 110.617 172.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.38 -31.52 70.95 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 122.022 -0.424 . . . . 10.0 110.647 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.75 -51.99 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 108.633 -0.877 . . . . 10.0 108.633 177.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.74 -41.95 74.59 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 118.951 -1.1 . . . . 10.0 111.251 -177.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -68.17 -22.05 64.86 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.809 1.644 . . . . 10.0 112.16 -177.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.42 -29.07 16.47 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.932 1.086 . . . . 10.0 113.932 166.535 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -106.05 -67.27 0.94 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.263 1.025 . . . . 10.0 112.933 -170.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.73 43.05 0.39 Allowed 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.883 1.273 . . . . 10.0 109.374 -179.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 t -126.79 -5.0 6.37 Favored 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 125.333 1.453 . . . . 10.0 113.501 -165.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 41.2 t -99.02 -51.63 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 124.985 1.314 . . . . 10.0 108.083 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 80.4 m -92.01 -59.01 2.21 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.426 1.891 . . . . 10.0 109.906 -174.091 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 -73.97 -16.92 61.06 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.033 1.123 . . . . 10.0 114.033 -171.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.7 t -65.34 -50.01 67.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.766 -0.584 . . . . 10.0 111.24 -178.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 tpt -106.96 -26.27 11.26 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.291 1.036 . . . . 10.0 112.256 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.78 55.22 1.33 Allowed Glycine 0 CA--C 1.535 1.343 0 C-N-CA 125.211 1.386 . . . . 10.0 111.9 -174.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 90.8 t -95.6 156.46 3.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 125.291 1.437 . . . . 10.0 109.69 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.12 25.95 11.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.218 1.007 . . . . 10.0 112.802 -174.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.74 7.44 88.21 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.105 0.86 . . . . 10.0 113.508 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.43 147.03 92.73 Favored Pre-proline 0 CA--C 1.55 0.977 0 CA-C-N 118.807 1.304 . . . . 10.0 112.35 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -67.12 172.23 10.22 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 125.099 3.866 . . . . 10.0 110.29 172.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -124.26 135.33 53.33 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.763 0.825 . . . . 10.0 111.52 -176.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 p -78.79 52.89 1.28 Allowed 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.825 -1.172 . . . . 10.0 113.166 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -146.54 -43.3 0.19 Allowed 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.885 1.439 . . . . 10.0 114.885 178.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.67 146.13 32.62 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.932 1.293 . . . . 10.0 108.877 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 38.2 m -94.44 -29.0 15.19 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.253 0.933 . . . . 10.0 110.155 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.46 -29.85 68.1 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.689 0.996 . . . . 10.0 113.689 177.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.458 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 60.7 t0 -71.32 -34.03 70.2 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.434 1.094 . . . . 10.0 109.26 174.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.434 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 49.0 m95 -90.03 -31.27 17.26 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 125.094 1.358 . . . . 10.0 113.254 -175.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -47.01 -56.59 11.48 Favored Pre-proline 0 CA--C 1.541 0.613 0 O-C-N 120.493 -1.379 . . . . 10.0 114.603 174.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.43 -0.02 4.59 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 122.579 2.186 . . . . 10.0 113.278 -178.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.401 ' C ' ' H ' ' A' ' 36' ' ' ALA . 19.8 mmm180 -93.6 -49.19 6.0 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.499 -0.751 . . . . 10.0 109.567 170.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.36 22.8 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.533 1.308 . . . . 10.0 114.533 170.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.401 ' H ' ' C ' ' A' ' 34' ' ' ARG . . . -93.94 -37.76 11.53 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.396 1.078 . . . . 10.0 109.698 176.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt -85.83 -46.01 11.04 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.948 0.899 . . . . 10.0 111.151 175.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 152.81 -143.58 10.46 Favored Glycine 0 CA--C 1.534 1.248 0 N-CA-C 110.353 -1.099 . . . . 10.0 110.353 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.8 t -123.76 -54.53 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.194 0.998 . . . . 10.0 110.901 -174.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.95 -13.85 7.6 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.443 1.497 . . . . 10.0 113.207 -178.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -72.84 -16.04 61.61 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 126.093 1.757 . . . . 10.0 113.47 175.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 mp -103.9 -43.99 5.16 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.228 0.611 . . . . 10.0 110.379 -171.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.3 p -53.8 -34.15 24.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.05 0.54 . . . . 10.0 111.103 170.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.6 ptmt -63.51 -43.96 95.68 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.823 -1.173 . . . . 10.0 113.91 170.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.5 m -66.55 -32.72 74.24 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 120.631 -1.293 . . . . 10.0 110.034 -178.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 40.5 t -60.43 -54.89 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 123.563 0.745 . . . . 10.0 111.099 172.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.62 -31.9 69.92 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.903 0.705 . . . . 10.0 112.903 178.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.8 m -71.1 -27.48 63.62 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.442 0.697 . . . . 10.0 112.471 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 74.31 90.68 0.17 Allowed Glycine 0 CA--C 1.529 0.969 0 CA-C-N 119.196 0.907 . . . . 10.0 112.539 -175.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.41 168.51 2.71 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.961 0.886 . . . . 10.0 111.634 173.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.43 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 8.5 m-80 -52.98 -57.96 8.58 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 120.468 -1.395 . . . . 10.0 112.85 -169.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.6 17.94 3.04 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.189 1.396 . . . . 10.0 112.722 173.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ttp -131.66 130.26 22.31 Favored Pre-proline 0 CA--C 1.545 0.763 0 N-CA-C 115.021 1.489 . . . . 10.0 115.021 -175.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.08 143.04 76.98 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 121.452 1.434 . . . . 10.0 112.309 -178.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -61.92 133.06 42.53 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 123.679 2.919 . . . . 10.0 109.946 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.79 11.75 85.13 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 119.579 -1.296 . . . . 10.0 112.735 -173.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 56.81 53.94 40.32 Favored Glycine 0 CA--C 1.532 1.138 0 O-C-N 120.74 -1.447 . . . . 10.0 110.88 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 80.12 -45.52 0.29 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.835 2.054 . . . . 10.0 112.603 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.08 162.39 25.89 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.642 0.777 . . . . 10.0 111.583 175.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.7 m -114.42 -57.41 2.28 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.315 1.046 . . . . 10.0 110.504 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -82.48 68.03 8.76 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 122.418 1.104 . . . . 10.0 109.871 -178.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.76 116.79 32.34 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.837 1.655 . . . . 10.0 110.432 -177.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -84.48 130.63 34.74 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 126.557 1.943 . . . . 10.0 109.334 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -45.58 -35.72 4.19 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.898 0.879 . . . . 10.0 113.261 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -50.17 -59.76 3.62 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.187 0.995 . . . . 10.0 113.162 167.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -74.62 -26.47 59.92 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 120.961 -1.087 . . . . 10.0 109.907 -177.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -55.82 14.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.909 1.284 . . . . 10.0 110.959 177.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.55 -44.49 96.93 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 177.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.75 -24.96 38.34 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.412 0.523 . . . . 10.0 112.412 173.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -85.61 -48.0 9.3 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.534 -0.729 . . . . 10.0 109.86 176.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.2 tp -57.42 -30.33 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.705 1.602 . . . . 10.0 112.747 178.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.63 -28.56 23.14 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.205 1.002 . . . . 10.0 113.549 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -51.87 -51.35 57.33 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.431 1.014 . . . . 10.0 112.139 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.434 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.3 mpp? -64.96 -36.87 85.78 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.718 0.636 . . . . 10.0 112.718 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -166.8 -74.18 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.465 0.706 . . . . 10.0 110.934 172.12 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 164.1 43.58 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 128.281 2.632 . . . . 10.0 110.842 -170.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.63 -81.58 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 115.418 1.636 . . . . 10.0 115.418 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.458 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 3.0 ptpt . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.282 -1.342 . . . . 10.0 113.925 -176.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 117.934 -1.032 . . . . 10.0 109.188 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -162.16 35.75 0.12 Allowed 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 122.68 1.228 . . . . 10.0 111.377 -164.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . 0.447 ' CD1' ' H ' ' A' ' -1' ' ' LEU . 0.0 OUTLIER -74.07 51.23 0.4 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.001 2.12 . . . . 10.0 112.245 172.278 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -101.51 -23.07 14.37 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.76 1.224 . . . . 10.0 111.013 173.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 58.5 t0 -149.52 119.82 7.32 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.198 0.999 . . . . 10.0 110.007 173.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -44.52 -42.34 7.12 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.004 1.321 . . . . 10.0 113.93 167.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -57.94 -46.58 84.83 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 122.208 -0.307 . . . . 10.0 110.428 173.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.41 -34.18 76.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.963 -0.461 . . . . 10.0 110.701 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.5 mm -64.86 -51.25 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 O-C-N 121.575 -0.703 . . . . 10.0 109.143 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.1 -42.01 76.68 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 117.791 -1.563 . . . . 10.0 111.988 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.61 -22.0 64.47 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.513 1.525 . . . . 10.0 112.579 -176.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -92.64 -29.21 16.24 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.548 1.139 . . . . 10.0 113.249 170.267 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.18 -64.49 1.29 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.143 0.977 . . . . 10.0 112.995 -170.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.04 37.81 0.16 Allowed 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.811 1.244 . . . . 10.0 110.887 178.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -120.57 -1.35 10.1 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 125.024 1.329 . . . . 10.0 113.316 -165.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.2 t -105.66 -46.57 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 124.647 1.179 . . . . 10.0 108.874 -171.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.9 m -87.82 -64.52 1.14 Allowed 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 125.703 1.601 . . . . 10.0 111.571 174.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -72.57 -25.57 61.4 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.565 0.746 . . . . 10.0 112.993 -162.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.8 t -55.01 -50.31 69.36 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.874 1.269 . . . . 10.0 111.094 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.5 tpt -106.08 -21.29 13.17 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.945 0.898 . . . . 10.0 112.635 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.56 45.27 3.76 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.138 0.875 . . . . 10.0 112.353 -176.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 57.7 t -86.06 160.18 3.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 124.568 1.147 . . . . 10.0 109.384 177.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.97 17.16 5.15 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.806 1.243 . . . . 10.0 113.531 -175.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.84 18.38 78.91 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.128 0.87 . . . . 10.0 113.417 -173.416 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.0 143.55 98.02 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-N 118.507 1.154 . . . . 10.0 112.831 -177.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -66.96 147.47 80.31 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.142 3.228 . . . . 10.0 110.118 177.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -69.1 139.49 54.77 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.792 -167.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 72.4 m -37.96 -35.3 0.15 Allowed 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.48 1.512 . . . . 10.0 114.512 173.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -141.94 108.75 5.4 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.737 1.615 . . . . 10.0 107.862 174.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -135.28 167.28 21.31 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.757 1.623 . . . . 10.0 106.737 171.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 88.2 m -110.84 -35.77 5.87 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.385 0.539 . . . . 10.0 112.123 171.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.05 -17.19 44.13 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 121.119 -0.988 . . . . 10.0 113.072 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -85.23 -29.77 24.39 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.272 1.829 . . . . 10.0 110.114 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.44 ' CH2' ' HE2' ' A' ' 78' ' ' LYS . 50.4 m95 -92.61 -38.34 11.94 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.869 2.068 . . . . 10.0 111.204 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -41.78 -60.52 1.89 Allowed Pre-proline 0 CA--C 1.552 1.038 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 173.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -64.24 -4.79 8.43 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.561 2.841 . . . . 10.0 114.053 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -98.25 -53.02 3.48 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.748 1.619 . . . . 10.0 108.308 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.4 mt -58.9 -19.39 41.79 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.566 1.547 . . . . 10.0 113.338 174.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.16 -30.58 55.07 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.143 1.377 . . . . 10.0 109.488 -177.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -82.57 -52.2 7.05 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.854 -0.424 . . . . 10.0 109.854 174.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.487 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 167.99 -125.26 1.28 Allowed Glycine 0 CA--C 1.532 1.106 0 N-CA-C 111.339 -0.704 . . . . 10.0 111.339 177.319 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.408 ' C ' ' H ' ' A' ' 41' ' ' ASN . 2.7 t -141.61 -59.71 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-O 122.105 0.955 . . . . 10.0 109.461 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -71.69 17.35 0.09 Allowed 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 124.277 1.031 . . . . 10.0 112.652 -173.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.487 HD22 ' N ' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -98.43 -18.36 18.29 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 128.249 2.62 . . . . 10.0 110.39 177.366 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -101.51 -41.92 6.44 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.999 0.92 . . . . 10.0 111.053 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.3 p -49.62 -35.38 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-O 121.477 0.656 . . . . 10.0 111.264 170.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 ptmt -63.66 -44.39 93.91 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 114.707 1.373 . . . . 10.0 114.707 172.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.14 -23.61 63.03 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 119.156 0.889 . . . . 10.0 110.91 178.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.0 t -67.33 -53.92 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 O-C-N 121.584 -0.697 . . . . 10.0 111.703 168.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.51 -34.82 74.65 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.949 -0.469 . . . . 10.0 112.035 177.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.64 -31.32 61.92 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.39 0.676 . . . . 10.0 112.169 177.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.0 105.5 0.15 Allowed Glycine 0 C--N 1.341 0.808 0 N-CA-C 111.485 -0.646 . . . . 10.0 111.485 -166.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.5 tp -63.14 172.01 2.04 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.877 -0.778 . . . . 10.0 110.247 167.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.408 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 7.8 m-80 -49.02 -58.27 5.18 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.742 1.217 . . . . 10.0 113.488 -169.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -86.09 18.97 2.81 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.018 1.327 . . . . 10.0 112.923 174.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 5.9 mtp -119.24 147.28 42.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 N-CA-C 114.269 1.211 . . . . 10.0 114.269 173.378 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.29 141.44 32.13 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.137 1.891 . . . . 10.0 110.425 172.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -61.6 124.36 14.48 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.003 2.469 . . . . 10.0 109.884 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.67 17.03 57.52 Favored Glycine 0 C--N 1.34 0.776 0 C-N-CA 119.994 -1.098 . . . . 10.0 111.824 -178.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 52.93 36.3 50.51 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 118.875 1.337 . . . . 10.0 113.511 172.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 66.54 21.99 10.65 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.323 1.849 . . . . 10.0 114.102 -175.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.9 t -122.74 166.61 14.65 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.287 1.835 . . . . 10.0 110.577 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.8 t -115.47 -55.59 2.43 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.393 1.077 . . . . 10.0 111.551 177.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -115.43 49.97 1.04 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.714 1.206 . . . . 10.0 110.99 -177.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.9 m -80.09 117.54 20.99 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 120.394 -1.441 . . . . 10.0 110.624 174.74 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 34.7 p -79.7 139.0 37.51 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -45.51 -32.22 2.14 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.757 0.823 . . . . 10.0 113.202 176.765 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -52.61 -61.8 2.05 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 119.257 0.935 . . . . 10.0 112.535 169.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -27.77 62.39 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.551 -0.718 . . . . 10.0 110.495 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -50.02 45.45 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.46 1.124 . . . . 10.0 109.972 -177.521 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -64.85 -51.65 60.88 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 124.58 1.152 . . . . 10.0 109.021 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.43 -35.07 12.07 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 118.871 0.759 . . . . 10.0 112.523 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.27 -34.04 61.31 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 120.946 -1.096 . . . . 10.0 112.213 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.65 -51.57 27.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.048 1.739 . . . . 10.0 110.7 175.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.6 -28.32 69.84 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.033 1.333 . . . . 10.0 112.881 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -42.16 -41.34 2.64 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.884 0.698 . . . . 10.0 112.884 170.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.412 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -77.59 -69.77 0.52 Allowed 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 111.998 0.369 . . . . 10.0 111.998 179.854 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.8 t -163.08 32.23 0.09 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.685 0.995 . . . . 10.0 113.685 -176.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 37.29 53.95 1.3 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.443 1.897 . . . . 10.0 115.047 177.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -140.77 -54.64 0.5 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.923 0.889 . . . . 10.0 112.836 -177.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.44 ' HE2' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.898 0 CA-C-O 116.666 -1.635 . . . . 10.0 110.559 171.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.897 0 CA-C-O 118.589 -0.72 . . . . 10.0 111.357 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -162.39 129.48 3.73 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.734 0.642 . . . . 10.0 112.734 -170.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.51 76.24 1.45 Allowed 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 122.676 1.227 . . . . 10.0 109.123 171.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.85 -24.96 8.84 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.928 1.291 . . . . 10.0 114.281 175.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.417 ' CG ' ' H ' ' A' ' 3' ' ' ALA . 15.0 t70 -136.93 -168.09 2.21 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 106.218 -1.771 . . . . 10.0 106.218 -177.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.417 ' H ' ' CG ' ' A' ' 2' ' ' ASP . . . -103.34 -41.75 5.93 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 127.522 2.329 . . . . 10.0 111.998 176.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -54.85 -51.5 65.7 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 122.195 0.997 . . . . 10.0 109.772 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.96 -30.08 69.28 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.144 -0.935 . . . . 10.0 110.858 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.56 -52.0 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.68 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -69.71 -40.08 76.49 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.758 0.708 . . . . 10.0 110.39 -176.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -68.94 -23.95 64.21 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.391 1.077 . . . . 10.0 112.035 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.41 -30.66 19.32 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.612 1.338 . . . . 10.0 114.612 166.335 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.65 -69.54 0.86 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.959 1.304 . . . . 10.0 111.637 -167.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.38 43.95 0.25 Allowed 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 125.516 1.526 . . . . 10.0 110.345 178.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.9 t -127.1 -7.13 5.98 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.701 1.601 . . . . 10.0 113.668 -167.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 48.4 t -94.17 -42.72 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 N-CA-C 108.243 -1.021 . . . . 10.0 108.243 -175.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.9 m -104.97 -57.2 2.06 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.737 1.615 . . . . 10.0 109.358 -173.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -74.13 -14.77 61.02 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 114.825 1.417 . . . . 10.0 114.825 -171.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.6 t -70.24 -43.99 69.44 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.434 0.693 . . . . 10.0 110.408 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 25.5 mmt -114.64 -40.42 3.58 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.271 1.428 . . . . 10.0 112.247 -175.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.21 61.67 1.13 Allowed Glycine 0 CA--C 1.535 1.322 0 C-N-CA 125.737 1.637 . . . . 10.0 112.682 -178.396 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 94.0 t -82.65 -56.53 5.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 121.631 0.729 . . . . 10.0 111.991 -175.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.97 30.79 0.44 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.909 0.884 . . . . 10.0 111.211 177.058 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 65.83 18.41 66.32 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 124.026 0.822 . . . . 10.0 113.195 -172.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.23 142.88 97.79 Favored Pre-proline 0 CA--C 1.539 0.536 0 O-C-N 121.681 -0.894 . . . . 10.0 111.676 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -75.27 149.38 35.55 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 122.841 2.361 . . . . 10.0 111.182 -172.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -63.58 134.5 55.6 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.041 -0.527 . . . . 10.0 112.34 -175.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.1 p -48.08 -22.96 0.7 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.079 1.752 . . . . 10.0 114.453 173.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.76 40.14 1.84 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.135 0.879 . . . . 10.0 113.125 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -77.09 151.36 35.48 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.524 -0.735 . . . . 10.0 110.607 169.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.3 m -107.51 -30.57 8.56 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.704 0.402 . . . . 10.0 110.978 165.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.63 -36.58 70.78 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.945 -1.097 . . . . 10.0 113.179 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -79.23 -30.18 43.09 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.91 0.862 . . . . 10.0 110.281 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.9 m95 -82.48 -31.56 29.28 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.967 1.707 . . . . 10.0 111.751 178.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -40.7 -62.04 1.08 Allowed Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.07 1.348 . . . . 10.0 113.954 172.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.17 6.66 2.08 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.851 2.367 . . . . 10.0 113.787 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 -108.49 -42.63 4.51 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.18 1.392 . . . . 10.0 109.345 177.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.05 6.12 2.32 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.081 1.752 . . . . 10.0 112.823 176.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.19 -34.96 37.01 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.53 1.532 . . . . 10.0 109.205 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -80.92 -61.01 2.09 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.3 170.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 150.17 -127.94 2.54 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.428 -0.669 . . . . 10.0 111.428 175.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.9 m -122.42 172.77 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 126.331 1.852 . . . . 10.0 109.172 175.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 63.15 9.5 3.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.838 1.255 . . . . 10.0 113.832 -176.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -92.63 -62.14 1.45 Allowed 'General case' 0 C--N 1.343 0.295 0 CA-C-O 122.419 1.104 . . . . 10.0 108.913 170.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.66 -26.66 60.01 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.734 0.814 . . . . 10.0 111.468 -172.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.01 -29.43 46.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 O-C-N 121.611 -0.681 . . . . 10.0 110.371 173.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -69.28 -43.0 74.76 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.538 -0.727 . . . . 10.0 110.976 176.109 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -39.09 93.08 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.507 -0.746 . . . . 10.0 109.939 176.196 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.4 t -56.12 -48.55 78.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.407 0.623 . . . . 10.0 111.85 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.97 -32.01 72.97 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.896 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 54.6 m -74.47 -29.66 61.54 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.083 0.953 . . . . 10.0 113.547 175.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.29 117.98 0.35 Allowed Glycine 0 CA--C 1.529 0.962 0 CA-C-N 119.306 0.957 . . . . 10.0 111.496 -170.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.6 tp -72.56 -145.3 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.162 0.985 . . . . 10.0 110.628 168.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -80.64 -67.24 0.79 Allowed 'General case' 0 N--CA 1.477 0.893 0 O-C-N 119.648 -1.907 . . . . 10.0 111.301 -174.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.2 -14.74 60.14 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.276 1.43 . . . . 10.0 111.381 176.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 ttp -97.67 120.44 60.48 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 123.726 0.81 . . . . 10.0 110.862 -175.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -70.74 157.22 59.11 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 121.718 1.612 . . . . 10.0 111.31 -175.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -62.49 116.88 3.8 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 123.031 2.488 . . . . 10.0 110.23 -179.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 98.49 35.91 4.78 Favored Glycine 0 C--N 1.344 1.018 0 CA-C-N 118.058 0.39 . . . . 10.0 113.104 -176.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 53.39 -86.66 0.01 OUTLIER Glycine 0 CA--C 1.537 1.425 0 C-N-CA 124.533 1.063 . . . . 10.0 113.998 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.6 ttt -171.98 40.16 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 127.242 2.217 . . . . 10.0 110.226 172.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.8 p -131.29 170.76 14.17 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.56 1.319 . . . . 10.0 114.56 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 55.3 m -81.99 -98.77 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.928 1.291 . . . . 10.0 109.966 175.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -82.35 64.29 6.94 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.957 -1.089 . . . . 10.0 109.434 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 4.2 m -60.75 86.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.807 0 CA-C-O 121.301 0.572 . . . . 10.0 111.495 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.3 p -78.23 132.27 37.48 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 120.776 -1.203 . . . . 10.0 108.186 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -46.77 -32.04 3.4 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.966 0.906 . . . . 10.0 112.515 178.049 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -52.72 -59.48 4.43 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.327 1.451 . . . . 10.0 113.968 166.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -73.89 -36.07 64.75 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 107.932 -1.136 . . . . 10.0 107.932 -175.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -55.92 -60.24 3.75 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 123.165 0.586 . . . . 10.0 111.064 172.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.8 ptmt -57.82 -48.32 80.09 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.338 1.055 . . . . 10.0 109.873 -177.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.94 -22.25 14.42 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.758 0.651 . . . . 10.0 112.758 172.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -101.79 -9.82 20.46 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 124.701 1.2 . . . . 10.0 113.859 -174.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -99.94 -38.76 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.962 0.905 . . . . 10.0 109.809 167.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -37.93 77.36 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.322 0.649 . . . . 10.0 111.698 175.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -49.93 -38.56 36.85 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.015 0.926 . . . . 10.0 112.462 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -79.35 -65.17 1.03 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.625 0.37 . . . . 10.0 111.991 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 t -164.3 27.94 0.07 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 119.451 -0.9 . . . . 10.0 112.917 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt 40.0 46.81 1.84 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.784 0.834 . . . . 10.0 113.134 -175.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.64 -84.66 0.47 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.887 1.275 . . . . 10.0 113.435 173.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.277 0 N-CA-C 115.651 1.722 . . . . 10.0 115.651 -164.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 121.126 0.488 . . . . 10.0 110.134 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -178.6 115.13 0.07 Allowed 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 106.969 -1.493 . . . . 10.0 106.969 -156.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.79 32.86 1.03 Allowed 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 113.325 0.861 . . . . 10.0 113.325 -177.148 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 8.4 mp0 -97.3 -25.27 15.31 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 123.209 0.604 . . . . 10.0 112.144 -176.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -141.62 123.38 15.22 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 108.636 -0.876 . . . . 10.0 108.636 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -54.1 -36.1 62.84 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 124.134 0.974 . . . . 10.0 112.679 172.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -59.04 -47.41 85.34 Favored 'General case' 0 C--N 1.34 0.17 0 N-CA-C 110.426 -0.212 . . . . 10.0 110.426 170.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.78 -34.33 76.58 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.743 -0.598 . . . . 10.0 110.621 -178.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 33.8 mt -64.37 -51.61 66.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 N-CA-C 108.428 -0.952 . . . . 10.0 108.428 178.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.447 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -69.29 -42.3 75.66 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 117.695 -1.602 . . . . 10.0 112.294 -179.757 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -68.86 -22.48 64.2 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.641 1.576 . . . . 10.0 112.752 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -94.78 -28.8 15.09 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.95 0.722 . . . . 10.0 112.95 170.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -108.11 -64.94 1.16 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.052 0.941 . . . . 10.0 112.562 -171.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.447 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.42 44.16 0.34 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.742 1.217 . . . . 10.0 110.483 179.278 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.5 t -129.8 -6.32 4.55 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 124.883 1.273 . . . . 10.0 113.794 -164.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.6 t -97.11 -46.74 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 124.779 1.231 . . . . 10.0 108.236 -176.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 82.3 m -92.07 -63.68 1.21 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 127.582 2.353 . . . . 10.0 110.507 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -73.61 -20.92 60.46 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.961 1.097 . . . . 10.0 113.961 -167.448 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.8 t -57.82 -53.59 56.46 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.505 1.122 . . . . 10.0 111.394 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.0 tpt -108.91 -12.78 14.84 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.768 0.827 . . . . 10.0 112.422 -178.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.42 40.84 7.64 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.266 0.936 . . . . 10.0 112.264 -175.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 68.8 t -80.08 155.91 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.469 1.108 . . . . 10.0 109.149 176.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 55.6 21.63 4.65 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.772 1.229 . . . . 10.0 113.619 -176.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.87 20.52 76.02 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 124.231 0.919 . . . . 10.0 113.842 -176.473 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.83 141.77 79.22 Favored Pre-proline 0 CA--C 1.547 0.856 0 CA-C-N 118.64 1.22 . . . . 10.0 113.681 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.31 132.7 13.97 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 124.763 3.642 . . . . 10.0 111.815 -176.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -61.49 142.77 56.8 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.705 -1.247 . . . . 10.0 113.835 -161.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.0 m -50.83 -33.59 24.27 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.347 0.869 . . . . 10.0 113.347 176.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -125.63 117.61 23.9 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.248 1.019 . . . . 10.0 108.698 167.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -151.8 163.55 38.94 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.278 1.831 . . . . 10.0 106.838 172.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 96.5 m -110.08 -36.6 5.81 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.45 0.568 . . . . 10.0 111.138 170.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.95 -19.61 34.34 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.501 -0.749 . . . . 10.0 113.02 -175.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -83.09 -34.08 26.22 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.279 1.432 . . . . 10.0 110.283 178.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.421 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 63.7 m95 -82.24 -40.73 21.2 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.233 1.813 . . . . 10.0 111.624 176.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -39.49 -60.11 1.39 Allowed Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 114.496 1.295 . . . . 10.0 114.496 175.099 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -65.04 -8.3 17.87 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.389 2.726 . . . . 10.0 114.151 -177.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -95.77 -53.48 3.69 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.845 0.858 . . . . 10.0 110.152 170.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.47 -18.88 4.76 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.641 1.577 . . . . 10.0 113.394 178.073 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.63 -32.81 36.14 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.637 1.575 . . . . 10.0 109.993 -176.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.54 -46.65 12.18 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.876 -0.787 . . . . 10.0 108.876 174.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 163.88 -142.82 8.09 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 110.892 -0.883 . . . . 10.0 110.892 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.4 t -134.63 -56.27 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 122.707 1.241 . . . . 10.0 109.673 -174.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.67 -29.86 28.76 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 127.167 2.187 . . . . 10.0 111.232 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -55.92 -20.12 14.8 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.421 1.888 . . . . 10.0 113.916 175.3 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -103.13 -43.53 5.45 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.844 0.858 . . . . 10.0 111.061 -175.184 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 p -53.69 -34.07 23.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 118.119 0.418 . . . . 10.0 111.185 171.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -59.29 -48.55 81.21 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.099 1.148 . . . . 10.0 114.099 167.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.9 m -62.86 -35.14 79.0 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 120.617 -1.302 . . . . 10.0 110.152 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 28.5 t -58.04 -54.18 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.055 173.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.5 ptmt -61.83 -33.74 74.7 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.573 0.582 . . . . 10.0 112.573 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 97.6 m -72.01 -33.54 68.14 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.48 0.712 . . . . 10.0 112.37 -178.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.54 98.34 0.42 Allowed Glycine 0 CA--C 1.531 1.08 0 CA-C-N 118.809 0.731 . . . . 10.0 111.929 -173.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 5.0 tp -67.48 170.13 8.01 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.279 1.031 . . . . 10.0 111.106 174.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -52.68 -57.65 9.38 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.736 -1.228 . . . . 10.0 112.365 -171.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.32 20.9 9.74 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.33 1.452 . . . . 10.0 112.383 172.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 40.3 ttp -125.6 125.34 25.01 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 114.001 1.112 . . . . 10.0 114.001 172.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -61.87 151.22 82.44 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.868 1.712 . . . . 10.0 111.925 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -61.57 140.15 85.36 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 123.171 2.58 . . . . 10.0 110.677 -177.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.75 30.76 73.43 Favored Glycine 0 CA--C 1.53 1.008 0 CA-C-N 116.502 -0.317 . . . . 10.0 112.734 -170.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.51 36.27 5.93 Favored Glycine 0 CA--C 1.536 1.396 0 O-C-N 121.693 -0.886 . . . . 10.0 114.314 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.2 ttt 84.93 12.41 0.26 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.936 2.094 . . . . 10.0 114.685 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.7 m -106.35 167.52 9.78 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.594 1.158 . . . . 10.0 112.338 171.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.1 m -131.19 -49.48 1.01 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.882 1.673 . . . . 10.0 110.167 171.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -79.43 -29.77 42.02 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.414 1.486 . . . . 10.0 112.693 -175.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 21.9 m -55.21 122.29 10.73 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.108 1.763 . . . . 10.0 111.197 179.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.0 m -103.0 162.22 13.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.55 1.94 . . . . 10.0 109.539 -176.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -44.98 -44.77 10.14 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.788 -1.195 . . . . 10.0 113.627 176.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -50.0 -40.11 43.34 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.838 0.855 . . . . 10.0 112.248 174.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -84.46 -44.08 14.0 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.619 0.767 . . . . 10.0 111.154 178.239 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -58.03 -50.2 74.23 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.895 -1.128 . . . . 10.0 112.285 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -58.41 -46.52 86.29 Favored 'General case' 0 N--CA 1.463 0.216 0 O-C-N 121.783 -0.573 . . . . 10.0 110.027 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.5 -34.34 64.52 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 121.923 0.868 . . . . 10.0 112.858 170.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.34 -41.28 63.65 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 120.222 -1.549 . . . . 10.0 111.456 -178.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.2 pt -75.69 -33.13 25.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 O-C-N 121.646 -0.659 . . . . 10.0 112.634 175.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -69.86 -32.69 71.2 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.566 -0.709 . . . . 10.0 111.206 174.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -48.51 -48.34 38.22 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 119.092 0.86 . . . . 10.0 111.167 172.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 73.3 mtm -71.76 -51.82 20.76 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.748 -0.66 . . . . 10.0 112.152 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -154.15 -79.29 0.1 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 117.595 0.18 . . . . 10.0 111.317 173.318 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 161.48 47.05 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.595 2.758 . . . . 10.0 110.68 -176.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.2 -88.58 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.478 0.918 . . . . 10.0 113.478 175.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.421 ' HE2' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.136 0 N-CA-C 115.205 1.557 . . . . 10.0 115.205 -172.061 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 118.27 -0.871 . . . . 10.0 109.533 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -159.89 126.53 4.4 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 108.815 -0.809 . . . . 10.0 108.815 -149.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.54 57.64 0.73 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.761 0.824 . . . . 10.0 113.06 -175.072 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.26 -21.49 14.33 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 114.036 1.125 . . . . 10.0 114.036 -170.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 47.4 t0 -143.5 -164.2 1.81 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.775 2.03 . . . . 10.0 107.193 -174.034 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.75 -44.26 4.07 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 127.29 2.236 . . . . 10.0 111.664 172.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -58.84 -48.35 81.65 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.941 -0.474 . . . . 10.0 111.649 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.44 -28.61 68.74 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.336 -0.852 . . . . 10.0 110.96 -177.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.4 mp -69.24 -51.65 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.128 -1.064 . . . . 10.0 108.128 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.34 -41.95 79.99 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 118.026 -1.47 . . . . 10.0 111.747 177.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -67.97 -22.11 65.04 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.956 1.702 . . . . 10.0 112.778 -176.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.58 -28.42 16.04 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.838 1.051 . . . . 10.0 113.838 167.383 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -105.73 -67.77 0.91 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.131 0.972 . . . . 10.0 112.057 -171.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.04 41.86 0.3 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 125.251 1.42 . . . . 10.0 110.365 -179.029 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -128.46 -7.11 5.23 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 125.657 1.583 . . . . 10.0 113.283 -167.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.2 t -94.52 -39.97 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.134 0.973 . . . . 10.0 108.54 -176.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.7 m -106.93 -55.71 2.29 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.779 1.632 . . . . 10.0 110.629 -172.055 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 20.0 m-70 -75.19 -19.67 59.69 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.665 1.357 . . . . 10.0 114.665 -172.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m -65.45 -51.64 58.76 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.464 0.705 . . . . 10.0 110.237 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.71 -34.59 10.47 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.092 1.357 . . . . 10.0 111.595 -177.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.09 57.74 1.0 Allowed Glycine 0 CA--C 1.537 1.451 0 C-N-CA 126.296 1.903 . . . . 10.0 112.508 -174.161 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 18.5 t -94.9 153.68 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 124.769 1.227 . . . . 10.0 110.435 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.09 20.84 5.85 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.241 1.416 . . . . 10.0 113.528 -177.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.9 22.31 69.27 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.561 1.077 . . . . 10.0 113.571 -173.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.69 143.14 94.69 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 118.516 1.158 . . . . 10.0 112.606 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 96.4 Cg_endo -74.22 146.99 36.93 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 124.776 3.651 . . . . 10.0 110.571 -179.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -74.54 135.45 42.15 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.812 -0.555 . . . . 10.0 111.657 -167.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.66 -34.12 4.81 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.651 1.18 . . . . 10.0 113.472 178.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 48.8 p-80 -125.32 103.57 8.0 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.803 1.641 . . . . 10.0 108.971 170.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -141.24 161.8 37.02 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 107.182 -1.414 . . . . 10.0 107.182 170.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 59.7 m -109.94 -35.6 6.1 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.408 0.549 . . . . 10.0 111.35 171.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.48 -12.65 45.38 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.295 -0.878 . . . . 10.0 113.293 -177.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.442 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 13.7 t0 -88.58 -25.77 22.31 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.641 1.576 . . . . 10.0 109.898 174.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.467 ' CZ3' ' OXT' ' A' ' 78' ' ' LYS . 63.4 m95 -96.68 -35.06 11.15 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.719 1.608 . . . . 10.0 111.095 -179.368 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.07 -52.64 19.14 Favored Pre-proline 0 CA--C 1.549 0.941 0 N-CA-C 114.694 1.368 . . . . 10.0 114.694 169.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -74.83 16.18 0.66 Allowed 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.933 2.422 . . . . 10.0 113.641 -179.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.409 ' C ' ' H ' ' A' ' 36' ' ' ALA . 2.2 mmt180 -122.07 -45.05 2.26 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.78 2.032 . . . . 10.0 108.827 176.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.41 0.96 0.09 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.054 1.742 . . . . 10.0 114.433 166.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.409 ' H ' ' C ' ' A' ' 34' ' ' ARG . . . -81.11 -27.08 35.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.98 1.312 . . . . 10.0 109.842 174.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -90.42 -57.08 2.96 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.4 0.68 . . . . 10.0 110.492 173.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 148.9 -115.69 0.75 Allowed Glycine 0 CA--C 1.531 1.083 0 C-N-CA 123.845 0.736 . . . . 10.0 111.279 174.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.52 173.79 13.47 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.163 0 C-N-CA 125.064 1.346 . . . . 10.0 110.893 171.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.258 16.0 m-20 69.3 -27.51 0.16 Allowed 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 125.48 1.512 . . . . 10.0 112.877 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.67 -26.86 68.86 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.014 -1.678 . . . . 10.0 113.859 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -99.55 -38.51 8.73 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.623 0.769 . . . . 10.0 111.07 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -54.52 -33.99 27.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 122.015 -0.428 . . . . 10.0 110.25 172.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 ptmt -59.11 -46.97 86.96 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.916 1.08 . . . . 10.0 113.916 169.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 55.5 m -68.53 -28.38 66.93 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 120.59 -1.319 . . . . 10.0 110.547 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.3 t -60.24 -54.06 40.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 O-C-N 121.657 -0.652 . . . . 10.0 111.481 170.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -33.84 73.5 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 111.951 0.352 . . . . 10.0 111.951 177.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.03 -35.39 66.76 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.514 0.561 . . . . 10.0 112.514 -178.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.74 112.67 0.21 Allowed Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.255 -0.738 . . . . 10.0 111.255 -167.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.6 -155.23 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.578 0.751 . . . . 10.0 110.523 170.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -73.13 -66.58 0.66 Allowed 'General case' 0 N--CA 1.475 0.802 0 O-C-N 119.67 -1.894 . . . . 10.0 111.608 -173.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.31 -16.51 61.37 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.508 1.123 . . . . 10.0 112.118 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.2 ttp -100.77 118.05 61.45 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 123.237 0.615 . . . . 10.0 111.826 -172.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.02 154.3 70.92 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.115 1.876 . . . . 10.0 111.926 -173.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -59.58 124.8 16.22 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 123.991 3.127 . . . . 10.0 110.973 -177.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.89 43.03 8.49 Favored Glycine 0 C--N 1.34 0.793 0 CA-C-O 118.954 -0.914 . . . . 10.0 111.249 -172.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 17.6 57.73 0.01 OUTLIER Glycine 0 CA--C 1.531 1.088 0 C-N-CA 126.976 2.227 . . . . 10.0 115.422 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 72.34 -51.98 0.7 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.003 1.321 . . . . 10.0 112.972 -172.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.6 p -79.63 87.57 5.18 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 173.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 68.3 p -55.79 -50.07 71.47 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.399 -0.813 . . . . 10.0 111.124 171.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -78.32 63.24 3.16 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.824 1.65 . . . . 10.0 110.166 178.72 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 2.9 m -131.12 122.84 27.38 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.863 1.265 . . . . 10.0 111.073 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.0 m -90.83 141.72 28.52 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 124.765 1.226 . . . . 10.0 109.368 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -43.07 -38.18 2.25 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.32 1.23 . . . . 10.0 114.32 177.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -47.81 -58.52 4.25 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.225 1.01 . . . . 10.0 112.417 169.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -74.52 -40.87 61.48 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.901 1.281 . . . . 10.0 110.168 -178.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -57.09 14.08 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.024 0.929 . . . . 10.0 109.811 178.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -51.53 68.28 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.688 1.195 . . . . 10.0 110.036 -177.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.4 -33.76 55.08 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.354 -0.841 . . . . 10.0 112.709 170.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.58 -31.73 47.35 Favored 'General case' 0 C--N 1.341 0.222 0 O-C-N 121.013 -1.055 . . . . 10.0 111.487 -175.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -78.81 -50.42 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-O 121.775 0.797 . . . . 10.0 109.471 173.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -53.68 -31.71 48.88 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.203 1.401 . . . . 10.0 112.17 176.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -49.82 -58.08 6.09 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 124.568 1.147 . . . . 10.0 112.197 172.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.431 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 4.9 mpp? -64.17 -57.05 10.68 Favored 'General case' 0 C--N 1.34 0.194 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 177.822 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -177.09 129.45 0.17 Allowed 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.519 -1.289 . . . . 10.0 107.519 174.073 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.02 74.16 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.587 1.955 . . . . 10.0 113.185 172.808 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -163.99 -65.4 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.484 1.514 . . . . 10.0 113.757 -171.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.467 ' OXT' ' CZ3' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.712 0 N-CA-C 116.006 1.854 . . . . 10.0 116.006 -165.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . 0.407 ' CMA' ' O ' ' A' ' 78' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.202 0 CA-C-O 120.486 0.184 . . . . 10.0 111.289 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -168.88 126.28 1.0 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.155 0.982 . . . . 10.0 108.645 -167.162 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -77.81 68.01 3.79 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.766 0.793 . . . . 10.0 110.218 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -113.52 -22.38 10.35 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.216 1.406 . . . . 10.0 114.123 176.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -146.97 117.37 7.43 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 -177.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -45.2 -40.58 7.41 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.529 1.131 . . . . 10.0 113.743 173.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -60.48 -49.64 76.74 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.356 -0.215 . . . . 10.0 110.667 172.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.55 -30.69 70.4 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.557 -0.715 . . . . 10.0 111.303 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 15.8 mt -66.73 -52.79 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.56 -40.92 80.43 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 117.921 -1.511 . . . . 10.0 111.16 -179.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -69.04 -21.95 64.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.041 1.737 . . . . 10.0 113.273 -178.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.14 -29.08 15.33 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 121.21 -0.931 . . . . 10.0 113.172 168.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.72 -66.72 1.01 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.356 1.062 . . . . 10.0 112.78 -171.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.04 39.64 0.19 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.116 1.366 . . . . 10.0 110.757 179.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -125.12 3.37 7.92 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.797 1.239 . . . . 10.0 113.62 -167.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.3 t -105.84 -52.55 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 124.71 1.204 . . . . 10.0 108.249 -174.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.5 m -84.49 -62.53 1.53 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.559 1.544 . . . . 10.0 111.08 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 72.4 m-70 -73.92 -23.87 59.6 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.943 1.46 . . . . 10.0 114.943 -167.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.42 -46.78 87.76 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.152 0.581 . . . . 10.0 110.456 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -109.51 -22.21 12.1 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.847 0.859 . . . . 10.0 111.871 -176.481 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.46 57.34 1.88 Allowed Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.032 0.825 . . . . 10.0 112.019 -175.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 46.4 t -103.34 161.24 4.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 125.375 1.47 . . . . 10.0 109.396 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.33 22.05 10.38 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.089 0.956 . . . . 10.0 113.163 -175.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 73.69 16.4 79.17 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 124.157 0.884 . . . . 10.0 113.199 -173.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.15 144.18 98.15 Favored Pre-proline 0 CA--C 1.543 0.699 0 CA-C-N 118.262 1.031 . . . . 10.0 113.366 -174.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -76.28 139.1 20.75 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 124.249 3.299 . . . . 10.0 111.015 -176.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 mttt -62.54 143.81 56.79 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.524 0.564 . . . . 10.0 112.524 -165.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t -49.14 -35.29 16.19 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.436 1.094 . . . . 10.0 113.511 177.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -142.01 57.78 1.48 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.829 0.852 . . . . 10.0 112.277 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -79.35 165.46 23.11 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 165.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.2 p -107.95 -35.91 6.5 Favored 'General case' 0 C--O 1.222 -0.377 0 O-C-N 121.67 -0.643 . . . . 10.0 111.417 164.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.06 -22.01 56.13 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 120.557 -1.34 . . . . 10.0 113.203 -176.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -87.78 -23.4 24.08 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.396 2.278 . . . . 10.0 110.259 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.497 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 43.7 m95 -97.28 -36.8 10.29 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.053 1.741 . . . . 10.0 110.776 178.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -41.64 -59.79 2.26 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.27 1.428 . . . . 10.0 114.037 174.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -64.04 -10.87 24.75 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 122.613 2.209 . . . . 10.0 113.833 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -96.43 -47.77 5.84 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.506 1.122 . . . . 10.0 110.084 176.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -17.58 64.75 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.442 1.897 . . . . 10.0 112.407 179.577 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -82.36 -38.05 24.77 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 125.026 1.33 . . . . 10.0 109.097 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt -68.01 -49.76 59.61 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.534 171.211 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 162.59 -132.9 2.91 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 112.142 -0.383 . . . . 10.0 112.142 178.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.403 ' C ' ' H ' ' A' ' 41' ' ' ASN . 3.3 t -137.86 -54.02 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 C-N-CA 123.875 0.87 . . . . 10.0 109.975 179.214 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -74.38 34.5 0.09 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.456 1.502 . . . . 10.0 113.251 -177.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.403 ' H ' ' C ' ' A' ' 39' ' ' VAL . 2.4 m-20 -111.08 -54.74 2.57 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.762 2.425 . . . . 10.0 106.27 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -77.15 -32.52 56.35 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.481 -0.762 . . . . 10.0 110.552 -175.497 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.95 -15.3 16.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 O-C-N 121.929 -0.482 . . . . 10.0 111.566 171.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -85.96 -49.11 8.1 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.421 0.688 . . . . 10.0 111.102 168.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.8 m -58.59 -38.87 78.86 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 120.428 1.467 . . . . 10.0 110.64 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.7 p -62.0 -42.94 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-O 121.425 0.631 . . . . 10.0 110.963 -178.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.8 -30.42 51.23 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.762 0.825 . . . . 10.0 111.922 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 53.4 m -74.63 -25.45 59.23 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.438 1.095 . . . . 10.0 112.618 176.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.97 115.16 0.34 Allowed Glycine 0 CA--C 1.529 0.912 0 CA-C-N 119.486 1.039 . . . . 10.0 111.99 -175.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.3 tp -105.77 -145.74 0.38 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.518 0.727 . . . . 10.0 111.008 177.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -80.27 141.66 35.32 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 122.566 1.175 . . . . 10.0 108.768 174.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 55.72 22.09 5.16 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 112.183 -2.281 . . . . 10.0 111.953 173.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.6 ttp -144.64 123.3 6.84 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.516 1.127 . . . . 10.0 110.571 -174.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.45 148.39 48.29 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 121.881 1.721 . . . . 10.0 112.038 -173.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -62.95 113.66 2.1 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 123.648 2.899 . . . . 10.0 110.189 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 114.7 -10.6 21.31 Favored Glycine 0 CA--C 1.529 0.929 0 O-C-N 123.566 0.541 . . . . 10.0 112.668 -170.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.07 49.48 78.03 Favored Glycine 0 CA--C 1.534 1.234 0 O-C-N 120.429 -1.63 . . . . 10.0 109.999 -175.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 76.39 -45.54 0.51 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.462 1.905 . . . . 10.0 112.812 -177.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.0 p -76.86 159.57 29.94 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.215 -0.928 . . . . 10.0 111.279 177.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 34.1 p -110.05 -69.43 0.86 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.315 1.046 . . . . 10.0 110.38 -177.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -78.87 54.68 1.6 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.882 1.273 . . . . 10.0 110.602 -179.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -86.22 115.83 24.03 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.443 1.097 . . . . 10.0 111.086 -176.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 50.0 m -91.69 126.94 36.95 Favored 'General case' 0 C--O 1.231 0.09 0 N-CA-C 108.568 -0.901 . . . . 10.0 108.568 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -43.96 -34.4 1.68 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.299 1.439 . . . . 10.0 113.174 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -43.81 -66.78 0.34 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.464 1.105 . . . . 10.0 113.275 163.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.67 -29.24 62.2 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.329 -0.857 . . . . 10.0 110.081 -177.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.03 -52.62 64.19 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.807 0.813 . . . . 10.0 111.358 179.232 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -66.69 -47.1 73.49 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-O 117.804 -1.093 . . . . 10.0 109.296 176.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.15 -29.67 5.74 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 120.097 1.317 . . . . 10.0 113.524 171.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.24 -36.61 22.59 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.397 1.079 . . . . 10.0 112.131 -177.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.0 mt -81.63 -47.55 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.86 1.264 . . . . 10.0 111.8 176.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.25 -34.7 33.61 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.336 1.454 . . . . 10.0 112.443 172.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -44.24 -39.71 4.64 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.785 0.834 . . . . 10.0 112.523 173.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.497 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -82.5 -70.43 0.55 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 122.771 0.428 . . . . 10.0 111.962 -178.456 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 t -161.34 32.48 0.14 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.674 0.79 . . . . 10.0 112.488 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.8 pttt 36.94 57.74 1.17 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.457 1.503 . . . . 10.0 114.588 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.05 -52.65 0.37 Allowed 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 113.841 1.052 . . . . 10.0 113.841 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.449 ' NZ ' ' O ' ' A' ' 78' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.911 0 C-N-CA 125.165 1.386 . . . . 10.0 113.443 -166.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.998 0 N-CA-C 108.097 -1.075 . . . . 10.0 108.097 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -163.46 126.54 2.67 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.261 -1.015 . . . . 10.0 108.261 176.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -74.62 68.94 1.7 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 122.046 0.927 . . . . 10.0 110.516 176.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -114.48 -20.2 10.87 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.452 1.501 . . . . 10.0 114.165 -178.234 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.448 ' CG ' ' H ' ' A' ' 3' ' ' ALA . 15.6 t70 -144.47 -153.39 0.47 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.958 1.303 . . . . 10.0 108.321 -174.184 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.448 ' H ' ' CG ' ' A' ' 2' ' ' ASP . . . -127.82 -40.4 1.72 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 128.335 2.654 . . . . 10.0 111.443 177.148 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -56.49 -46.69 80.35 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.449 0.642 . . . . 10.0 110.47 175.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.96 -31.52 72.15 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.877 -0.514 . . . . 10.0 110.746 -178.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.3 mp -69.3 -52.34 34.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 N-CA-C 107.983 -1.117 . . . . 10.0 107.983 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.427 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -68.27 -39.47 82.15 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 118.181 -1.408 . . . . 10.0 111.325 -179.148 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -69.39 -22.83 63.68 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.204 1.402 . . . . 10.0 113.003 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.64 -30.98 16.04 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.667 0.988 . . . . 10.0 113.667 167.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.01 -64.89 1.21 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.24 1.016 . . . . 10.0 111.946 -166.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.427 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.74 41.2 0.2 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.627 1.171 . . . . 10.0 110.912 177.43 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -128.81 0.25 5.39 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 125.66 1.584 . . . . 10.0 113.631 -166.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.5 t -101.97 -51.11 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 124.62 1.168 . . . . 10.0 108.199 -176.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.6 m -88.67 -64.1 1.2 Allowed 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.119 1.768 . . . . 10.0 109.933 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.3 m-70 -73.65 -11.19 60.34 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.05 1.5 . . . . 10.0 115.05 -166.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.35 -36.68 63.62 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.124 0.97 . . . . 10.0 110.908 178.723 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -125.23 -37.42 2.4 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.753 1.221 . . . . 10.0 112.24 -172.419 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.35 64.15 1.17 Allowed Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.75 1.643 . . . . 10.0 112.909 175.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 73.5 t -84.67 -56.66 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 123.657 0.783 . . . . 10.0 111.925 -176.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.1 33.23 0.44 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.941 0.897 . . . . 10.0 111.128 177.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 63.59 21.8 65.25 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 124.497 1.046 . . . . 10.0 113.258 -174.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.97 137.95 97.14 Favored Pre-proline 0 CA--C 1.545 0.756 0 O-C-N 121.813 -0.816 . . . . 10.0 112.564 -174.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -70.08 135.55 29.96 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.645 2.897 . . . . 10.0 110.3 -175.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.5 mtmm -53.58 133.62 41.26 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.155 -0.966 . . . . 10.0 112.578 -171.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.4 p -55.68 -14.16 2.07 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.824 1.046 . . . . 10.0 113.824 173.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -145.82 45.65 1.27 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.436 1.094 . . . . 10.0 111.848 177.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -76.64 167.95 20.94 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.407 -0.808 . . . . 10.0 109.82 166.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.7 t -109.15 -35.65 6.25 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.875 -0.516 . . . . 10.0 111.53 161.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.83 -21.14 51.94 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.181 -1.574 . . . . 10.0 113.345 -174.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -82.77 -26.69 31.63 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.08 2.152 . . . . 10.0 110.006 177.063 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.493 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 41.0 m95 -94.5 -36.34 11.9 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.841 1.656 . . . . 10.0 110.846 -177.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -45.33 -56.78 8.66 Favored Pre-proline 0 CA--C 1.545 0.778 0 O-C-N 120.811 -1.181 . . . . 10.0 113.635 174.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -76.47 21.57 0.55 Allowed 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.167 2.578 . . . . 10.0 113.133 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -125.37 -47.98 1.71 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.582 1.953 . . . . 10.0 109.02 175.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -19.66 47.14 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.799 2.44 . . . . 10.0 112.036 173.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.41 -28.45 37.81 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 124.526 1.131 . . . . 10.0 110.124 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.6 mmmt -74.93 -51.26 14.23 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 174.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.468 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 158.3 -117.34 0.77 Allowed Glycine 0 CA--C 1.531 1.06 0 C-N-CA 124.686 1.136 . . . . 10.0 110.403 177.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.446 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -144.01 -56.64 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 124.294 1.038 . . . . 10.0 110.764 177.606 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.49 17.17 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.486 1.115 . . . . 10.0 113.371 -176.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.468 HD22 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -97.89 -22.97 16.04 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 125.754 1.621 . . . . 10.0 110.526 177.428 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -104.43 -43.14 5.26 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.338 1.055 . . . . 10.0 110.031 -175.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -54.36 -33.22 25.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 O-C-N 121.72 -0.613 . . . . 10.0 111.151 171.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -63.68 -43.45 96.63 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.217 -0.927 . . . . 10.0 113.112 172.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.7 m -66.16 -34.15 77.4 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.203 -0.935 . . . . 10.0 110.371 177.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 31.3 t -56.87 -54.86 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 122.491 0.317 . . . . 10.0 110.995 174.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -35.08 68.91 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.952 0.723 . . . . 10.0 112.952 175.785 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 22.6 m -71.58 -36.13 70.78 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.05 0.54 . . . . 10.0 111.999 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.48 95.68 0.6 Allowed Glycine 0 CA--C 1.528 0.904 0 CA-C-N 118.862 0.756 . . . . 10.0 111.23 -174.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.1 tp -60.13 169.39 1.58 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 122.138 0.971 . . . . 10.0 111.839 173.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.416 ' H ' ' ND2' ' A' ' 51' ' ' ASN . 13.7 m-80 -50.32 -55.95 13.35 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.71 -1.244 . . . . 10.0 112.603 -174.039 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -95.29 20.39 9.36 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 113.799 -1.546 . . . . 10.0 112.073 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 39.7 ttp -129.08 130.63 23.42 Favored Pre-proline 0 CA--C 1.551 1.019 0 N-CA-C 114.478 1.288 . . . . 10.0 114.478 175.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -64.02 157.43 53.1 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 121.992 1.794 . . . . 10.0 112.182 177.497 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -60.12 137.0 72.66 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.791 2.327 . . . . 10.0 110.118 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 62.16 27.9 69.8 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-O 118.927 -0.93 . . . . 10.0 113.756 -175.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 48.21 33.85 11.63 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.128 1.347 . . . . 10.0 113.782 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 71.15 45.58 0.49 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.973 1.309 . . . . 10.0 112.077 -175.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.8 t -125.5 -52.6 1.6 Allowed 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.592 -0.693 . . . . 10.0 111.669 163.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.9 m 70.2 -69.47 0.17 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.993 1.317 . . . . 10.0 110.818 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -84.16 55.06 3.17 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.878 0.871 . . . . 10.0 110.699 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.3 m -114.65 140.56 48.73 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.354 1.462 . . . . 10.0 109.644 173.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 59.9 m -101.78 146.55 27.62 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.525 1.13 . . . . 10.0 109.492 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -41.92 -39.84 1.97 Allowed 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 115.063 1.505 . . . . 10.0 115.063 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -42.71 -63.59 0.76 Allowed 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.758 1.163 . . . . 10.0 112.607 167.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.82 -40.05 63.62 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.541 1.936 . . . . 10.0 109.613 -175.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -59.12 5.83 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.923 0.889 . . . . 10.0 110.065 178.02 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt -59.16 -46.29 88.77 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.525 1.13 . . . . 10.0 109.411 178.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.01 -26.48 37.28 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.3 -0.875 . . . . 10.0 112.415 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.85 -6.64 57.2 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 125.212 1.405 . . . . 10.0 112.648 -174.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.51 -40.27 4.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 125.447 1.499 . . . . 10.0 110.335 167.482 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.81 -40.71 76.47 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.71 0.804 . . . . 10.0 111.108 175.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -52.64 -36.8 57.34 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.893 0.701 . . . . 10.0 112.893 176.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.493 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 2.6 mpp? -75.3 -66.03 0.82 Allowed 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 121.819 -0.55 . . . . 10.0 111.562 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -166.53 35.37 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 119.569 -0.853 . . . . 10.0 112.519 -178.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt 37.29 51.65 1.13 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.861 0.864 . . . . 10.0 113.301 -176.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -141.3 -82.93 0.21 Allowed 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.012 1.116 . . . . 10.0 114.012 170.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.489 ' NZ ' ' O ' ' A' ' 78' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.984 0 N-CA-C 115.733 1.753 . . . . 10.0 115.733 -164.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.128 0 N-CA-C 113.0 0.741 . . . . 10.0 113.0 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -166.71 122.7 1.19 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.187 -1.042 . . . . 10.0 108.187 -178.366 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.56 38.81 0.12 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.868 1.062 . . . . 10.0 113.868 -179.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -98.68 -26.23 14.44 Favored 'General case' 0 N--CA 1.461 0.11 0 O-C-N 121.298 -0.876 . . . . 10.0 113.081 -174.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -141.24 127.42 19.65 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.995 -1.113 . . . . 10.0 107.995 172.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.96 -36.99 75.75 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.965 0.906 . . . . 10.0 112.003 175.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -61.94 -48.41 80.53 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 120.401 -0.52 . . . . 10.0 110.934 172.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.08 -31.0 71.61 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 121.34 -0.85 . . . . 10.0 109.848 -177.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 mm -65.77 -52.78 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 117.698 -1.144 . . . . 10.0 109.248 173.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -68.17 -39.55 82.52 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 121.258 1.844 . . . . 10.0 112.153 -178.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -69.74 -22.32 63.38 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.288 2.235 . . . . 10.0 111.926 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.89 -27.12 15.33 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.035 1.124 . . . . 10.0 114.035 166.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -104.98 -70.67 0.77 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.131 1.372 . . . . 10.0 112.557 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.49 42.07 0.27 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.937 1.695 . . . . 10.0 110.418 -178.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.0 t -127.48 -5.49 5.91 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 125.172 1.389 . . . . 10.0 113.677 -164.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 42.1 t -95.87 -53.5 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 CA-C-O 122.311 1.053 . . . . 10.0 108.167 -175.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 29.2 m -93.04 -55.24 3.41 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.525 1.53 . . . . 10.0 109.261 -171.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -72.76 -19.8 61.3 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.677 1.191 . . . . 10.0 113.334 -172.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.9 t -63.62 -49.6 72.67 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.18 0.592 . . . . 10.0 110.879 -178.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.7 tpt -112.08 -27.21 8.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.332 1.053 . . . . 10.0 112.977 -177.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.64 58.62 2.01 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 124.781 1.181 . . . . 10.0 112.859 -177.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 96.2 t -82.63 -58.22 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 121.898 -0.766 . . . . 10.0 112.204 -175.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.55 32.01 0.41 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.873 0.869 . . . . 10.0 111.044 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 63.62 23.91 67.44 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 123.747 0.689 . . . . 10.0 112.832 -172.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.94 145.15 97.71 Favored Pre-proline 0 CA--C 1.544 0.731 0 O-C-N 121.769 -0.842 . . . . 10.0 111.142 176.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.94 144.86 35.01 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.73 2.953 . . . . 10.0 110.873 -174.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -65.53 138.31 57.97 Favored 'General case' 0 C--O 1.239 0.534 0 O-C-N 121.796 -0.565 . . . . 10.0 111.897 -171.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.6 m -19.58 -51.26 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 128.189 2.596 . . . . 10.0 115.206 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -144.68 53.1 1.24 Allowed 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.999 0.428 . . . . 10.0 111.45 173.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -53.34 153.79 3.73 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.348 -0.845 . . . . 10.0 110.105 164.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 94.2 m -100.6 -35.56 9.46 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.203 -0.936 . . . . 10.0 111.001 169.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.09 -23.37 28.53 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 120.966 -1.084 . . . . 10.0 112.595 -171.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -81.71 -32.88 31.43 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.119 1.768 . . . . 10.0 109.768 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 43.6 m95 -85.08 -35.45 21.82 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.313 1.845 . . . . 10.0 111.459 178.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -42.64 -58.77 3.43 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 114.349 1.24 . . . . 10.0 114.349 174.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -73.27 15.58 0.5 Allowed 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 123.209 2.606 . . . . 10.0 113.743 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.03 -49.71 2.5 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.81 1.644 . . . . 10.0 108.95 173.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.9 mt -54.65 -12.01 0.68 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.407 1.483 . . . . 10.0 114.38 170.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.91 -37.16 16.69 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 125.117 1.367 . . . . 10.0 110.019 -173.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.0 mtpt -77.98 -47.07 19.37 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 166.63 -126.2 1.43 Allowed Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.892 -0.883 . . . . 10.0 110.892 173.373 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 86.5 t -138.62 -64.57 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 C-N-CA 123.399 0.68 . . . . 10.0 110.96 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.13 -35.7 59.99 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 119.065 -0.493 . . . . 10.0 111.373 -174.244 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -33.68 -42.22 0.11 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.742 1.217 . . . . 10.0 112.566 171.124 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -81.37 -42.6 20.25 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.744 1.218 . . . . 10.0 112.524 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -53.52 -33.95 22.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 O-C-N 121.078 -1.014 . . . . 10.0 110.981 169.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -44.31 96.98 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.394 -0.817 . . . . 10.0 112.622 169.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.6 m -61.47 -37.32 83.19 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 120.598 -1.314 . . . . 10.0 110.249 174.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 7.0 t -63.6 -55.1 24.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 122.866 0.466 . . . . 10.0 111.592 -178.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.03 -32.62 64.19 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 176.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.3 m -72.23 -30.0 64.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.936 0.895 . . . . 10.0 112.077 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 74.97 94.64 0.14 Allowed Glycine 0 CA--C 1.53 0.983 0 CA-C-N 118.98 0.809 . . . . 10.0 111.903 -176.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.2 tp -65.0 170.5 4.32 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.93 -0.747 . . . . 10.0 111.696 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -48.84 -58.19 5.21 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.612 -1.305 . . . . 10.0 112.946 -170.563 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.03 24.92 5.14 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.15 1.38 . . . . 10.0 112.768 173.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 35.3 ttp -132.01 127.19 21.0 Favored Pre-proline 0 CA--C 1.554 1.097 0 N-CA-C 114.5 1.296 . . . . 10.0 114.5 172.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.09 157.34 53.89 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 122.035 1.823 . . . . 10.0 112.937 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -64.78 129.92 24.74 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 123.663 2.908 . . . . 10.0 110.593 -175.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.02 25.46 74.67 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 121.575 -0.345 . . . . 10.0 112.429 -170.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.16 -46.3 2.7 Favored Glycine 0 CA--C 1.534 1.24 0 O-C-N 121.369 -1.077 . . . . 10.0 114.178 170.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -174.13 -48.27 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.387 2.275 . . . . 10.0 109.997 171.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.8 t -79.56 131.49 36.03 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.724 1.61 . . . . 10.0 110.9 177.374 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.5 m -89.54 -50.0 6.35 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 122.027 0.917 . . . . 10.0 110.212 173.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -78.88 60.6 2.9 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.725 2.41 . . . . 10.0 110.064 179.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 21.4 m -134.3 148.32 50.75 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.98 1.712 . . . . 10.0 110.615 174.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 59.4 m -108.93 155.78 20.45 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.639 1.576 . . . . 10.0 109.859 -178.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -46.17 -40.66 11.51 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.438 1.095 . . . . 10.0 112.99 177.326 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -57.12 -47.47 81.02 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.611 -0.68 . . . . 10.0 111.868 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.32 -44.07 63.22 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.812 -0.811 . . . . 10.0 108.812 -179.41 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -55.71 -49.95 71.63 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.266 0.555 . . . . 10.0 111.955 176.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -67.75 -52.55 36.07 Favored 'General case' 0 C--O 1.218 -0.603 0 CA-C-O 118.071 -0.966 . . . . 10.0 108.777 -176.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.39 -39.3 15.01 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.736 1.153 . . . . 10.0 112.859 171.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.05 -50.26 50.11 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.387 -0.821 . . . . 10.0 110.825 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 51.2 mt -58.31 -37.74 65.04 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.026 0 C-N-CA 125.498 1.519 . . . . 10.0 112.212 172.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -68.41 -38.22 81.05 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 126.778 2.031 . . . . 10.0 111.596 175.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -52.03 -36.18 49.35 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.538 0.57 . . . . 10.0 112.538 172.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 66.1 mtm -80.45 -71.97 0.43 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.777 0.831 . . . . 10.0 112.633 -179.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 7.0 t -162.96 45.59 0.13 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.742 -0.599 . . . . 10.0 111.78 172.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.2 ptpt 36.11 57.98 0.99 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.048 1.739 . . . . 10.0 114.948 176.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.21 -80.01 0.04 OUTLIER 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 112.425 0.528 . . . . 10.0 112.425 171.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.254 1.312 0 N-CA-C 116.005 1.854 . . . . 10.0 116.005 -169.083 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.386 0 N-CA-C 112.859 0.689 . . . . 10.0 112.859 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -161.25 98.66 1.16 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.569 1.548 . . . . 10.0 107.877 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.9 31.45 1.04 Allowed 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.361 1.064 . . . . 10.0 112.714 -176.372 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -97.72 -21.7 16.84 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 122.066 -0.396 . . . . 10.0 111.95 -171.797 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -143.85 125.22 14.72 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.775 1.23 . . . . 10.0 108.217 172.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -49.54 -39.24 33.84 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.36 1.064 . . . . 10.0 112.558 170.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -59.97 -45.06 93.92 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 122.365 -0.209 . . . . 10.0 111.175 171.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.6 -34.25 76.63 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.366 -0.834 . . . . 10.0 110.667 -179.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.6 mt -64.37 -52.75 51.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 N-CA-C 108.432 -0.951 . . . . 10.0 108.432 178.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.41 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.65 -39.83 76.85 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 117.962 -1.495 . . . . 10.0 111.998 -178.147 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -68.46 -22.6 64.56 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.118 1.367 . . . . 10.0 112.45 -177.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.65 -28.73 15.82 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.444 0.905 . . . . 10.0 113.444 170.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.03 -67.7 0.96 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.854 0.862 . . . . 10.0 112.373 -171.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.41 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.78 45.07 0.4 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 125.119 1.368 . . . . 10.0 110.159 -178.574 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.9 t -125.91 -15.13 5.98 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 120.495 -1.378 . . . . 10.0 113.859 -162.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -95.02 -30.36 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.596 1.158 . . . . 10.0 109.1 -175.328 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 96.1 m -107.4 -64.12 1.23 Allowed 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 128.254 2.622 . . . . 10.0 109.624 -173.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -74.8 -19.38 60.22 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.929 1.085 . . . . 10.0 113.929 -168.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.8 t -61.88 -50.67 71.27 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.502 0.721 . . . . 10.0 110.891 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.6 mmt -109.15 -13.96 14.58 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.311 1.444 . . . . 10.0 112.731 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.91 45.6 7.59 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.43 1.014 . . . . 10.0 112.087 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 91.9 t -90.52 159.88 2.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 124.855 1.262 . . . . 10.0 109.512 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.11 19.0 5.66 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.677 1.191 . . . . 10.0 113.754 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.62 7.38 75.46 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.555 1.074 . . . . 10.0 113.804 -175.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.53 147.87 96.83 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 118.403 1.101 . . . . 10.0 113.234 -172.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -68.46 164.09 34.1 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 123.677 2.918 . . . . 10.0 110.351 174.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -84.76 142.68 29.64 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.523 -0.736 . . . . 10.0 111.919 -176.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -45.84 -28.06 1.0 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.449 1.5 . . . . 10.0 113.837 172.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -135.31 125.01 25.28 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.867 0.867 . . . . 10.0 109.282 164.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -155.03 157.86 38.25 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.374 1.87 . . . . 10.0 106.496 172.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 75.7 m -108.39 -36.41 6.25 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.728 0.695 . . . . 10.0 111.464 171.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.28 -29.55 53.87 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.379 -0.825 . . . . 10.0 112.205 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -75.98 -34.58 59.77 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.392 1.477 . . . . 10.0 110.177 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.426 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 58.9 m95 -84.7 -34.06 23.02 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.752 2.021 . . . . 10.0 112.024 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -39.01 -61.73 0.89 Allowed Pre-proline 0 CA--C 1.546 0.797 0 N-CA-C 114.719 1.377 . . . . 10.0 114.719 173.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.32 -16.62 52.49 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.766 2.311 . . . . 10.0 113.265 -177.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.4 mmt180 -87.5 -51.68 5.78 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.886 1.274 . . . . 10.0 109.269 -179.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.36 -17.53 30.72 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.509 1.524 . . . . 10.0 113.413 174.283 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.16 -38.6 12.05 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 125.479 1.511 . . . . 10.0 109.97 -173.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -62.25 -51.67 66.79 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.145 -0.48 . . . . 10.0 109.806 167.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.7 -129.85 2.24 Favored Glycine 0 CA--C 1.533 1.174 0 N-CA-C 111.092 -0.803 . . . . 10.0 111.092 176.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.409 ' C ' ' H ' ' A' ' 41' ' ' ASN . 5.2 t -134.05 -58.03 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 123.848 0.859 . . . . 10.0 109.663 179.13 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.87 19.09 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.891 1.676 . . . . 10.0 114.63 -175.991 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.409 ' H ' ' C ' ' A' ' 39' ' ' VAL . 1.2 m-20 -97.4 -26.22 14.94 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 127.591 2.356 . . . . 10.0 110.189 174.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -94.58 -47.48 6.51 Favored 'General case' 0 N--CA 1.445 -0.675 0 C-N-CA 123.694 0.797 . . . . 10.0 109.736 -175.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -51.93 -32.92 15.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.657 1.183 . . . . 10.0 112.29 173.041 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -71.38 -37.56 71.57 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 120.427 -1.42 . . . . 10.0 112.838 172.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 2.6 t -75.87 -36.06 59.67 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.582 1.553 . . . . 10.0 110.996 -175.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.8 p -65.92 -48.27 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 O-C-N 121.408 -0.807 . . . . 10.0 110.852 168.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -34.51 76.13 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.954 -0.698 . . . . 10.0 111.266 -176.049 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.2 t -74.95 -32.61 61.78 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.798 -0.564 . . . . 10.0 112.018 174.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.5 112.1 1.0 Allowed Glycine 0 CA--C 1.532 1.144 0 C-N-CA 123.904 0.764 . . . . 10.0 112.684 -173.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.61 -175.51 4.39 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.68 0.792 . . . . 10.0 110.835 169.51 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -55.02 -64.44 0.83 Allowed 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.308 -1.495 . . . . 10.0 113.706 -162.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.52 8.1 6.98 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 115.598 -0.728 . . . . 10.0 112.5 173.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.19 138.91 19.68 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 114.113 1.153 . . . . 10.0 114.113 -175.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.38 140.42 52.76 Favored 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.094 1.862 . . . . 10.0 110.966 174.881 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -65.05 102.43 0.44 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.458 2.772 . . . . 10.0 109.649 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 110.35 12.37 17.54 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.342 0.496 . . . . 10.0 113.435 -175.07 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 56.15 34.75 62.91 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 118.663 1.232 . . . . 10.0 111.876 -177.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 73.59 -7.08 1.64 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.202 2.201 . . . . 10.0 114.074 -177.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.4 t -106.03 114.3 28.36 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.889 0.768 . . . . 10.0 112.113 -173.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 32.4 p -72.48 -53.4 12.22 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.321 1.048 . . . . 10.0 110.892 175.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -101.31 77.18 1.77 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.699 2.0 . . . . 10.0 109.024 177.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 12.0 m -123.87 132.63 53.79 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 121.572 -0.705 . . . . 10.0 110.844 161.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.8 p -79.25 163.27 25.09 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 122.159 -0.338 . . . . 10.0 110.198 171.053 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.98 -40.48 73.34 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.635 -0.666 . . . . 10.0 112.546 168.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.26 -51.83 63.31 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.728 0.695 . . . . 10.0 110.585 175.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -72.62 -36.6 68.11 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 122.23 -0.294 . . . . 10.0 111.34 -177.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -61.32 -52.17 65.81 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.749 -1.219 . . . . 10.0 111.334 173.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -63.37 -46.88 84.47 Favored 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 123.922 0.889 . . . . 10.0 109.823 -177.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.24 -40.86 49.01 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 121.323 0.582 . . . . 10.0 112.221 168.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.5 -39.82 70.57 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.865 -1.147 . . . . 10.0 112.051 -178.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.59 -55.49 19.58 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 124.078 0.951 . . . . 10.0 111.295 171.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -23.07 65.92 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 120.906 -1.121 . . . . 10.0 113.65 -177.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -43.69 -48.12 7.84 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.066 0.848 . . . . 10.0 111.364 168.087 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.426 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 3.6 mpp? -72.05 -50.02 31.86 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 112.228 0.455 . . . . 10.0 112.228 -179.249 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.84 -75.37 0.15 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.996 -0.526 . . . . 10.0 112.071 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 155.6 50.95 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 129.582 3.153 . . . . 10.0 111.589 -177.377 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -164.26 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.344 1.239 . . . . 10.0 114.344 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.27 0 N-CA-C 114.855 1.428 . . . . 10.0 114.855 -176.473 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 117.233 -1.365 . . . . 10.0 108.407 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -161.88 109.0 1.37 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.193 0.906 . . . . 10.0 110.375 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 1.7 tp -115.45 86.33 2.44 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.236 1.815 . . . . 10.0 109.62 -178.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -113.32 -20.29 11.42 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.906 1.817 . . . . 10.0 115.906 177.009 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.427 ' CG ' ' H ' ' A' ' 3' ' ' ALA . 14.5 t70 -147.53 -160.4 1.16 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.563 1.545 . . . . 10.0 107.664 -174.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.427 ' H ' ' CG ' ' A' ' 2' ' ' ASP . . . -117.51 -40.2 3.08 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 128.609 2.764 . . . . 10.0 111.469 177.352 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.21 -46.85 82.53 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.239 0.542 . . . . 10.0 110.203 174.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.9 -29.33 69.19 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.72 -0.613 . . . . 10.0 110.91 -175.078 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.1 mp -67.92 -53.0 33.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 108.236 -1.024 . . . . 10.0 108.236 177.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.4 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.6 OUTLIER -68.44 -40.52 81.11 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 117.309 -1.756 . . . . 10.0 111.359 -178.762 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -69.61 -22.62 63.48 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.62 1.568 . . . . 10.0 113.164 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -96.38 -28.7 14.34 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.679 0.992 . . . . 10.0 113.679 170.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.47 -64.27 1.27 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.571 0.748 . . . . 10.0 112.011 -168.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.4 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.1 OUTLIER -73.92 29.13 0.08 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.591 1.157 . . . . 10.0 111.837 177.737 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -110.23 5.2 21.63 Favored 'General case' 0 CA--C 1.522 -0.124 0 O-C-N 120.583 -1.323 . . . . 10.0 113.984 -163.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 23.9 t -107.08 -44.4 7.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 125.048 1.339 . . . . 10.0 108.976 -172.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.7 m -95.85 -63.43 1.15 Allowed 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.92 2.088 . . . . 10.0 111.313 -177.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 35.9 m-70 -73.82 -23.26 59.63 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.606 0.965 . . . . 10.0 113.606 -167.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.1 t -58.47 -45.97 87.58 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.566 1.146 . . . . 10.0 111.041 -178.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 25.9 mmt -111.78 -20.55 12.03 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.983 1.313 . . . . 10.0 112.68 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.87 48.32 3.67 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 123.823 0.725 . . . . 10.0 112.16 -176.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 74.4 t -92.94 161.54 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 C-N-CA 125.107 1.363 . . . . 10.0 109.26 177.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.64 20.04 5.97 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.589 1.156 . . . . 10.0 113.328 -174.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 71.95 26.37 72.72 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.219 0.914 . . . . 10.0 113.293 -173.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.69 144.19 76.48 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 113.926 1.084 . . . . 10.0 113.926 -176.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -80.24 124.06 5.25 Favored 'Trans proline' 0 CA--C 1.537 0.646 1 C-N-CA 125.475 4.117 . . . . 10.0 111.759 -174.8 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -57.39 141.85 45.79 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 125.115 1.366 . . . . 10.0 112.485 -160.423 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.7 m -49.86 -56.94 8.52 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.532 0.568 . . . . 10.0 112.532 175.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -108.48 94.43 5.06 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 122.147 0.975 . . . . 10.0 111.098 178.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -135.72 166.5 23.13 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.226 1.41 . . . . 10.0 108.136 176.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.4 m -107.25 -38.59 5.93 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 118.259 0.482 . . . . 10.0 111.164 169.158 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.4 -16.15 47.02 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 120.868 -1.145 . . . . 10.0 113.22 -174.198 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -89.12 -23.49 22.47 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.199 1.8 . . . . 10.0 110.395 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 81.1 m95 -96.62 -36.0 10.87 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 126.443 1.897 . . . . 10.0 111.631 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -42.16 -58.64 3.28 Favored Pre-proline 0 CA--C 1.549 0.915 0 N-CA-C 114.436 1.272 . . . . 10.0 114.436 172.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.14 15.54 0.75 Allowed 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.517 2.812 . . . . 10.0 113.397 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.401 ' C ' ' H ' ' A' ' 36' ' ' ALA . 5.4 mmt85 -116.62 -45.42 2.8 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.555 1.542 . . . . 10.0 108.599 176.146 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.51 3.91 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.738 2.015 . . . . 10.0 114.916 165.803 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.401 ' H ' ' C ' ' A' ' 34' ' ' ARG . . . -87.02 -30.07 21.49 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.55 1.14 . . . . 10.0 110.289 177.442 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? -88.66 -56.04 3.46 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.902 0.481 . . . . 10.0 110.056 174.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.63 -122.33 1.11 Allowed Glycine 0 CA--C 1.531 1.089 0 C-N-CA 124.492 1.044 . . . . 10.0 110.526 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.5 -58.48 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 C-N-CA 124.181 0.992 . . . . 10.0 110.929 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.73 35.54 0.13 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.604 1.562 . . . . 10.0 113.369 -170.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -113.04 -57.65 2.26 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 128.017 2.527 . . . . 10.0 107.514 179.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mt -67.23 -29.5 69.16 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.916 1.286 . . . . 10.0 110.263 -175.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -55.69 -17.61 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 126.04 1.736 . . . . 10.0 113.743 168.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.9 mtmt -93.23 -43.38 8.85 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 172.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.4 m -61.8 -32.3 72.58 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.121 0.962 . . . . 10.0 109.749 177.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.5 p -69.9 -38.52 75.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 170.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.4 -32.77 68.8 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.344 -0.848 . . . . 10.0 112.443 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.1 t -75.47 -36.64 60.61 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.819 0.848 . . . . 10.0 113.211 173.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 82.77 117.66 0.56 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.607 -0.597 . . . . 10.0 111.607 -167.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.29 -150.87 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.268 0.627 . . . . 10.0 110.062 164.178 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -75.95 -67.23 0.7 Allowed 'General case' 0 N--CA 1.476 0.834 0 O-C-N 119.482 -2.011 . . . . 10.0 112.156 -172.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.68 -12.35 59.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.899 1.279 . . . . 10.0 111.919 174.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 mmm -78.24 129.31 75.62 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.151 0.58 . . . . 10.0 111.497 172.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.28 145.45 59.99 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 121.685 1.59 . . . . 10.0 110.071 176.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -61.59 130.06 30.2 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.656 2.237 . . . . 10.0 109.736 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.76 26.7 66.57 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 119.397 -1.382 . . . . 10.0 112.051 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 40.91 34.99 0.86 Allowed Glycine 0 CA--C 1.534 1.264 0 C-N-CA 126.123 1.821 . . . . 10.0 115.903 177.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.72 38.21 18.46 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.758 1.223 . . . . 10.0 112.868 -175.637 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -126.84 147.91 50.01 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.702 2.001 . . . . 10.0 109.666 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.7 m -116.15 -77.93 0.57 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.341 0.657 . . . . 10.0 110.245 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -79.1 46.3 0.69 Allowed 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.55 1.14 . . . . 10.0 111.055 -173.276 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 4.5 m -125.52 138.69 53.98 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.171 1.788 . . . . 10.0 110.918 -166.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 45.8 m -112.17 -103.33 0.4 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.979 0.809 . . . . 10.0 109.948 -171.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -139.74 -48.42 0.46 Allowed 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 124.568 1.147 . . . . 10.0 109.011 -178.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -43.84 -60.27 1.89 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 120.325 1.421 . . . . 10.0 113.854 175.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -74.32 -29.93 61.83 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.596 0.712 . . . . 10.0 110.217 -178.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -44.85 95.67 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.226 -0.921 . . . . 10.0 113.058 177.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -62.35 -56.34 19.28 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 124.547 1.139 . . . . 10.0 108.373 174.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.42 -33.34 30.07 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.76 -47.25 75.86 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.242 -0.911 . . . . 10.0 111.829 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -57.01 -47.83 82.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.702 0.801 . . . . 10.0 111.119 170.048 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -64.38 -36.39 83.98 Favored 'General case' 0 C--O 1.228 -0.074 0 O-C-N 121.243 -0.911 . . . . 10.0 113.192 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -49.57 -49.69 45.36 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.728 0.695 . . . . 10.0 111.088 176.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 75.8 mtm -66.45 -45.16 80.74 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.996 0.518 . . . . 10.0 112.39 -179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.56 -71.79 0.09 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 118.774 -0.632 . . . . 10.0 112.566 172.477 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt 152.21 57.87 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 130.073 3.349 . . . . 10.0 112.106 -178.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -170.56 -75.52 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 114.505 1.298 . . . . 10.0 114.505 170.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.3 pttp . . . . . 0 C--O 1.254 1.303 0 C-N-CA 125.666 1.586 . . . . 10.0 114.626 -172.571 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.125 0 CA-C-O 117.408 -1.282 . . . . 10.0 109.187 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -162.82 127.51 3.11 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.679 0.792 . . . . 10.0 110.39 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.92 72.75 0.79 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.762 2.025 . . . . 10.0 108.767 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -102.96 -25.38 13.48 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.838 1.255 . . . . 10.0 112.31 172.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -149.43 112.93 5.0 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.64 0.776 . . . . 10.0 110.027 178.822 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -32.17 -46.65 0.13 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.816 2.046 . . . . 10.0 115.158 162.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.0 tt0 -58.66 -48.58 80.58 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 118.833 0.742 . . . . 10.0 110.724 173.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.46 -33.98 76.23 Favored 'General case' 0 C--O 1.226 -0.159 0 O-C-N 121.893 -0.504 . . . . 10.0 110.327 -177.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.7 mm -65.83 -51.0 66.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-O 118.459 -0.781 . . . . 10.0 109.212 176.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.425 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -67.8 -40.41 83.89 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 117.686 -1.605 . . . . 10.0 111.445 -179.656 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -68.88 -23.38 64.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.389 1.476 . . . . 10.0 112.957 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -27.85 15.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.985 1.314 . . . . 10.0 112.831 171.802 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.71 -65.81 1.15 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.76 1.224 . . . . 10.0 113.456 -172.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.425 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.94 45.58 0.35 Allowed 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 124.159 0.984 . . . . 10.0 110.148 179.731 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.0 t -129.22 -15.14 4.21 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 120.459 -1.401 . . . . 10.0 113.856 -162.502 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 19.6 m -97.59 -42.83 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 C-N-CA 124.185 0.994 . . . . 10.0 109.552 -177.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.7 m -85.8 -64.34 1.17 Allowed 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 126.831 2.052 . . . . 10.0 110.262 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -73.49 -26.1 60.74 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.637 0.977 . . . . 10.0 113.637 -165.159 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.0 t -56.06 -49.27 74.24 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.896 0.878 . . . . 10.0 111.136 -178.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.0 mmt -112.88 -9.21 13.66 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.726 0.81 . . . . 10.0 112.445 -178.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.61 42.88 8.12 Favored Glycine 0 CA--C 1.533 1.197 0 O-C-N 121.575 -0.703 . . . . 10.0 111.896 -179.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 50.1 t -88.89 161.27 2.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 125.081 1.352 . . . . 10.0 109.12 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.7 18.16 4.59 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.42 1.088 . . . . 10.0 113.933 -175.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 84.54 11.55 77.35 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.69 1.138 . . . . 10.0 113.787 -176.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.08 152.09 94.78 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-N 118.702 1.251 . . . . 10.0 113.757 -174.148 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -76.75 138.42 18.92 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.12 2.546 . . . . 10.0 110.83 -176.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.62 127.38 22.73 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.226 1.01 . . . . 10.0 113.008 -173.356 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 91.0 p 0.84 -82.39 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 128.15 2.58 . . . . 10.0 115.349 171.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.6 p80 -144.66 110.95 5.55 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 122.073 0.939 . . . . 10.0 110.051 170.636 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -128.45 -178.37 4.54 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.589 1.556 . . . . 10.0 110.235 174.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.9 t -99.35 -32.79 10.99 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.333 0.515 . . . . 10.0 112.11 169.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.42 -53.48 57.07 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.585 -1.322 . . . . 10.0 114.306 -171.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -79.74 -21.86 43.98 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.622 0.725 . . . . 10.0 110.837 -178.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.404 ' CZ3' ' HG2' ' A' ' 78' ' ' LYS . 71.9 m95 -79.64 -29.28 40.95 Favored 'General case' 0 CA--C 1.554 1.114 0 O-C-N 121.348 -0.845 . . . . 10.0 112.259 174.511 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -47.12 -61.41 2.85 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.641 1.576 . . . . 10.0 114.955 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -62.91 -16.39 53.61 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.186 1.924 . . . . 10.0 112.914 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.6 mmt85 -82.92 -46.43 12.97 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.766 1.226 . . . . 10.0 108.34 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -63.11 -17.9 62.83 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.381 1.872 . . . . 10.0 112.518 172.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.18 -33.15 26.26 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.452 1.101 . . . . 10.0 109.666 177.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -74.84 -51.62 13.5 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 122.236 0.215 . . . . 10.0 111.075 171.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 156.21 -104.52 0.25 Allowed Glycine 0 CA--C 1.531 1.082 0 C-N-CA 123.088 0.375 . . . . 10.0 112.626 170.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.54 -61.62 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 123.98 0.912 . . . . 10.0 110.439 175.672 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.71 36.44 0.16 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.333 1.453 . . . . 10.0 113.096 -170.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -111.99 -54.1 2.64 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.786 -1.931 . . . . 10.0 105.786 -176.632 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -79.56 -33.71 41.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.201 1.0 . . . . 10.0 111.618 -177.592 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -64.02 -11.21 9.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.65 -0.656 . . . . 10.0 111.8 170.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.6 mmpt? -78.78 -45.3 21.3 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.017 -1.052 . . . . 10.0 111.383 163.186 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 33.9 m -63.9 -38.27 90.45 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 120.294 -1.504 . . . . 10.0 110.766 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -56.57 -39.45 62.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 121.424 0.631 . . . . 10.0 111.968 177.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.39 -29.66 53.25 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.003 0.521 . . . . 10.0 111.776 -179.811 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 99.2 m -73.11 -32.12 64.74 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.447 0.699 . . . . 10.0 112.623 175.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.12 111.54 0.92 Allowed Glycine 0 C--N 1.34 0.778 0 N-CA-C 110.327 -1.109 . . . . 10.0 110.327 -170.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.44 -163.18 0.09 Allowed 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.685 1.194 . . . . 10.0 109.278 162.571 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -74.12 -67.42 0.61 Allowed 'General case' 0 N--CA 1.476 0.826 0 O-C-N 119.888 -1.758 . . . . 10.0 112.492 -170.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.38 -33.9 77.04 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.217 1.007 . . . . 10.0 111.166 173.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -73.03 128.96 87.07 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 126.4 1.88 . . . . 10.0 112.086 -172.166 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.16 144.23 68.18 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 121.632 1.555 . . . . 10.0 110.135 177.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -61.27 126.38 19.23 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.551 2.167 . . . . 10.0 109.439 175.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.06 25.53 19.31 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 120.987 -0.625 . . . . 10.0 112.939 179.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.83 35.11 4.23 Favored Glycine 0 CA--C 1.543 1.837 0 CA-C-N 118.002 0.901 . . . . 10.0 114.507 -177.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 14.3 ttm 70.13 -4.04 1.64 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.247 2.219 . . . . 10.0 114.926 -176.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.51 -38.88 6.61 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.064 -1.023 . . . . 10.0 112.511 -179.096 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 72.9 m 67.38 -60.65 0.37 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.517 1.927 . . . . 10.0 112.86 -176.36 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -79.64 57.05 2.37 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.724 1.21 . . . . 10.0 110.351 -177.296 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -112.15 123.0 49.31 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.154 1.382 . . . . 10.0 110.655 -171.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.4 t -93.57 133.31 37.01 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 173.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -32.37 -41.73 0.06 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.893 2.077 . . . . 10.0 113.326 171.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -40.61 -61.29 0.96 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.692 1.197 . . . . 10.0 113.7 170.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.12 -28.3 24.09 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.674 0.67 . . . . 10.0 111.383 178.102 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -43.7 78.31 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.948 -1.095 . . . . 10.0 111.244 176.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.7 ptmm? -72.49 -45.16 60.77 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.513 1.125 . . . . 10.0 109.698 178.076 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.25 -38.03 38.72 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 121.798 0.809 . . . . 10.0 111.889 173.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.29 -41.78 76.34 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.912 0.885 . . . . 10.0 111.851 -176.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 27.3 pt -76.24 -42.28 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 O-C-N 121.751 -0.593 . . . . 10.0 111.761 175.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . 0.258 5.7 pt-20 -64.67 -25.09 67.8 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.659 -0.651 . . . . 10.0 111.905 177.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -49.33 -44.43 44.48 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.587 0.63 . . . . 10.0 112.112 164.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 70.0 mtm -82.0 -57.26 3.49 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.464 0.705 . . . . 10.0 110.332 178.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.1 t -177.65 121.21 0.11 Allowed 'General case' 0 C--O 1.223 -0.31 0 C-N-CA 126.822 2.049 . . . . 10.0 108.207 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.57 83.1 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.001 -1.062 . . . . 10.0 112.984 178.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -157.76 -69.58 0.09 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 114.055 1.131 . . . . 10.0 114.055 -178.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.404 ' HG2' ' CZ3' ' A' ' 31' ' ' TRP . 4.7 ptpp? . . . . . 0 C--O 1.249 1.072 0 C-N-CA 124.198 0.999 . . . . 10.0 112.103 -177.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 117.205 -1.378 . . . . 10.0 109.409 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -162.56 134.38 5.31 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.387 0.994 . . . . 10.0 111.012 -170.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.83 51.72 0.39 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.848 1.259 . . . . 10.0 112.701 -174.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.39 -18.55 18.23 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.15 0.98 . . . . 10.0 113.134 -166.242 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.418 ' CG ' ' H ' ' A' ' 3' ' ' ALA . 15.1 t70 -138.18 -172.46 3.28 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.35 2.26 . . . . 10.0 106.399 179.213 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.418 ' H ' ' CG ' ' A' ' 2' ' ' ASP . . . -89.56 -45.65 9.23 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.653 2.381 . . . . 10.0 111.562 174.551 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -55.02 -50.09 69.9 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-O 121.931 0.872 . . . . 10.0 110.43 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.82 -31.44 69.33 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.464 -177.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -66.72 -52.06 49.45 Favored 'Isoleucine or valine' 0 C--N 1.34 0.18 0 N-CA-C 108.273 -1.01 . . . . 10.0 108.273 176.081 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -41.49 75.99 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 119.461 1.028 . . . . 10.0 110.328 -174.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -69.14 -23.97 64.03 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.464 1.106 . . . . 10.0 112.254 -178.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.7 ttpp -86.16 -30.48 22.45 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.18 -0.95 . . . . 10.0 113.423 166.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.38 -69.5 0.86 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.226 1.011 . . . . 10.0 112.84 -164.419 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.39 31.9 0.09 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.876 1.67 . . . . 10.0 111.234 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.9 t -111.38 8.71 21.38 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 124.624 1.17 . . . . 10.0 113.268 -164.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.7 t -111.42 -45.88 5.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.772 1.229 . . . . 10.0 108.902 -173.035 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.7 m -92.44 -64.24 1.13 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.946 1.699 . . . . 10.0 111.423 176.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -73.08 -25.65 60.97 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.425 0.69 . . . . 10.0 112.426 -166.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.03 -53.43 55.93 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.648 1.179 . . . . 10.0 111.014 -179.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.6 ttt -105.43 -21.03 13.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.283 1.033 . . . . 10.0 112.047 -178.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.95 53.48 2.37 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.111 0.862 . . . . 10.0 112.095 -175.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.8 t -95.05 162.66 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 125.131 1.372 . . . . 10.0 109.299 177.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 60.01 16.37 5.8 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.657 1.183 . . . . 10.0 113.976 -177.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.5 22.12 79.13 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 123.524 0.583 . . . . 10.0 113.028 -171.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.95 157.07 77.84 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 124.104 0.962 . . . . 10.0 112.07 177.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -72.79 165.27 33.23 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 122.577 2.185 . . . . 10.0 110.606 -178.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.9 tptt -77.37 126.42 30.88 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.652 -175.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.7 t -34.02 -42.69 0.13 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.391 2.276 . . . . 10.0 114.573 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.0 p-80 -138.59 133.51 32.6 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 108.459 -0.941 . . . . 10.0 108.459 157.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -148.59 168.43 22.79 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 125.565 1.546 . . . . 10.0 108.75 170.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.3 t -104.75 -36.83 7.29 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 120.567 -0.453 . . . . 10.0 111.438 164.459 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.57 -23.47 42.73 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 119.959 -1.713 . . . . 10.0 114.025 -174.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -82.68 -34.58 27.32 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.092 1.357 . . . . 10.0 109.33 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.45 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 45.9 m95 -85.82 -34.44 21.08 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 125.899 1.68 . . . . 10.0 111.907 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -43.63 -57.27 5.91 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 125.227 1.411 . . . . 10.0 114.43 174.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -65.25 -5.67 11.63 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.648 2.232 . . . . 10.0 113.898 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.446 HH11 ' CGA' ' A' ' 90' ' ' HEC . 8.8 mmt180 -103.05 -46.99 4.48 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.863 1.265 . . . . 10.0 110.369 179.038 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.2 mt -55.06 -4.3 0.07 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.883 1.673 . . . . 10.0 114.405 166.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.67 -33.31 17.62 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.087 1.355 . . . . 10.0 110.193 -176.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.53 -54.36 6.23 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 171.341 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.418 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 166.58 -132.89 2.75 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 110.916 -0.874 . . . . 10.0 110.916 -177.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 62.5 t -140.39 -56.92 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 124.181 0.992 . . . . 10.0 110.476 -173.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -69.88 11.19 0.31 Allowed 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 113.701 1.0 . . . . 10.0 113.701 -176.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.418 HD22 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -92.68 -21.67 19.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 127.516 2.327 . . . . 10.0 111.143 -179.69 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.4 -32.16 8.25 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.522 0.729 . . . . 10.0 110.874 -177.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.8 p -60.31 -23.79 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 125.68 1.592 . . . . 10.0 111.281 169.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.53 -44.66 57.08 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 121.363 -0.835 . . . . 10.0 111.875 167.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -76.05 -23.87 55.12 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 120.989 -1.069 . . . . 10.0 111.901 -174.319 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . 0.435 HG12 ' CZ ' ' A' ' 67' ' ' TYR . 1.7 p -68.95 -40.64 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 O-C-N 121.027 -1.045 . . . . 10.0 111.129 172.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.64 -31.0 66.38 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.149 0.5 . . . . 10.0 111.372 -178.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 1.5 t -89.43 -22.39 22.54 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.0 1.32 . . . . 10.0 112.495 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.05 117.56 0.82 Allowed Glycine 0 CA--C 1.535 1.307 0 N-CA-C 111.355 -0.698 . . . . 10.0 111.355 -170.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 tp -74.42 -152.48 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.992 0 O-C-N 122.031 -0.687 . . . . 10.0 110.393 169.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -65.27 -63.9 0.99 Allowed 'General case' 0 N--CA 1.471 0.618 0 O-C-N 119.753 -1.842 . . . . 10.0 111.592 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -101.39 44.19 1.02 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 113.282 -1.781 . . . . 10.0 109.084 -175.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -143.12 134.76 12.91 Favored Pre-proline 0 CA--C 1.536 0.42 0 C-N-CA 124.58 1.152 . . . . 10.0 111.606 -177.623 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.42 156.41 45.65 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 121.866 1.711 . . . . 10.0 110.211 176.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.67 120.52 7.64 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 122.759 2.306 . . . . 10.0 110.165 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.6 34.97 6.35 Favored Glycine 0 CA--C 1.531 1.087 0 O-C-N 122.091 -0.381 . . . . 10.0 113.242 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 57.18 -84.27 0.01 OUTLIER Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.556 1.074 . . . . 10.0 114.345 172.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -175.0 38.93 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.986 2.114 . . . . 10.0 112.376 165.322 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.45 147.77 49.08 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.751 1.221 . . . . 10.0 111.153 -175.905 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.8 t -71.42 -50.13 34.93 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -173.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -123.81 76.13 1.41 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.229 1.412 . . . . 10.0 108.473 175.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 8.3 m -71.87 91.1 1.15 Allowed 'General case' 0 CA--C 1.538 0.5 0 O-C-N 120.889 -1.132 . . . . 10.0 111.19 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -78.51 149.39 33.14 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 121.151 -0.968 . . . . 10.0 108.495 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.79 -37.32 76.07 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 120.315 1.416 . . . . 10.0 112.084 172.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.2 pt-20 -51.49 -46.6 63.22 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 119.065 -0.493 . . . . 10.0 111.608 174.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 -82.85 -39.43 21.64 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.829 0.74 . . . . 10.0 112.624 176.584 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . 0.435 ' CZ ' HG12 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -55.99 -46.22 78.78 Favored 'General case' 0 N--CA 1.463 0.22 0 O-C-N 120.5 -1.375 . . . . 10.0 111.543 -178.226 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -68.5 -45.79 71.39 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 -177.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.66 -38.97 61.37 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 121.633 0.73 . . . . 10.0 112.647 169.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.05 -39.55 29.56 Favored 'General case' 0 C--O 1.225 -0.226 0 O-C-N 120.602 -1.311 . . . . 10.0 113.592 -174.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.0 mt -70.38 -38.18 73.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 O-C-N 121.831 -0.543 . . . . 10.0 110.466 171.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . 0.299 0.0 OUTLIER -69.59 -31.71 70.02 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 114.195 1.183 . . . . 10.0 114.195 176.629 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -42.02 -47.14 4.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.628 1.171 . . . . 10.0 112.17 173.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.45 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.2 mpp? -81.65 -73.14 0.4 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.505 0.558 . . . . 10.0 112.505 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.2 33.87 0.17 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.155 0.582 . . . . 10.0 112.063 178.59 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.269 16.0 ptpt 42.62 46.81 4.4 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.892 1.677 . . . . 10.0 114.137 -179.297 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -150.97 -92.71 0.06 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.965 1.469 . . . . 10.0 114.965 -178.864 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.4 pttt . . . . . 0 C--O 1.253 1.25 0 N-CA-C 116.071 1.878 . . . . 10.0 116.071 -175.666 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . 0.446 ' CGA' HH11 ' A' ' 34' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.335 0 N-CA-C 112.75 0.648 . . . . 10.0 112.75 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -167.4 128.39 1.51 Allowed 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 123.212 0.605 . . . . 10.0 109.943 -171.38 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 2.6 tp -76.78 67.96 2.93 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.434 0.561 . . . . 10.0 110.831 177.659 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -111.52 -19.69 12.46 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.817 1.043 . . . . 10.0 113.817 179.369 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.437 ' CG ' ' H ' ' A' ' 3' ' ' ALA . 16.8 t70 -139.69 -137.44 0.12 Allowed 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.365 1.066 . . . . 10.0 110.366 -172.162 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.437 ' H ' ' CG ' ' A' ' 2' ' ' ASP . . . -147.94 -49.45 0.17 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 130.344 3.457 . . . . 10.0 109.302 -174.61 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -54.26 -50.51 67.07 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 121.247 0.546 . . . . 10.0 110.301 171.103 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 -29.75 68.69 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 121.777 -0.577 . . . . 10.0 111.415 -176.363 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.5 mp -68.8 -52.67 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.932 -1.136 . . . . 10.0 107.932 178.004 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.23 -41.25 81.53 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 118.225 -1.39 . . . . 10.0 110.918 -179.612 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -68.51 -22.95 64.5 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.132 1.373 . . . . 10.0 112.546 -176.779 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.72 -29.74 16.66 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.37 1.248 . . . . 10.0 114.37 166.298 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.27 -66.19 1.09 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.104 0.865 . . . . 10.0 112.363 -167.121 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.2 42.84 0.27 Allowed 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 124.126 0.971 . . . . 10.0 109.883 177.604 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.7 t -122.56 -6.88 8.64 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 120.477 -1.389 . . . . 10.0 114.03 -164.056 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.8 m -105.88 -41.97 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 123.59 0.756 . . . . 10.0 109.352 -178.219 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 m -86.88 -63.91 1.23 Allowed 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.657 1.583 . . . . 10.0 110.136 177.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -74.1 -28.23 61.26 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.277 1.214 . . . . 10.0 114.277 -167.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.1 t -59.58 -51.36 70.15 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.565 0.746 . . . . 10.0 111.408 -179.049 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 28.9 mmt -101.76 -19.49 15.33 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.434 0.694 . . . . 10.0 111.844 -179.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.18 49.59 4.17 Favored Glycine 0 CA--C 1.532 1.143 0 O-C-N 121.428 -0.795 . . . . 10.0 111.986 -178.222 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 66.6 t -99.29 162.95 2.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 126.127 1.771 . . . . 10.0 109.313 -177.816 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.68 19.66 8.34 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.411 1.084 . . . . 10.0 113.367 -176.237 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 81.23 10.29 84.94 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 124.522 1.058 . . . . 10.0 113.142 -174.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.96 144.49 95.77 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-N 118.422 1.111 . . . . 10.0 112.767 -176.863 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -81.14 151.77 18.25 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 124.784 3.656 . . . . 10.0 110.392 179.349 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.2 mptt -103.25 143.2 32.96 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.211 -166.308 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.3 p -77.05 55.23 1.11 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.207 1.003 . . . . 10.0 112.46 175.131 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -146.96 -45.59 0.18 Allowed 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 114.072 1.138 . . . . 10.0 114.072 175.939 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -71.25 149.2 46.45 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 108.369 -0.974 . . . . 10.0 108.369 -177.925 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 9.5 t -95.46 -30.5 13.83 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 118.652 0.66 . . . . 10.0 110.139 178.111 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.42 -29.08 69.72 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 114.65 1.352 . . . . 10.0 114.65 -178.234 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -76.42 -31.39 57.88 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 122.34 1.067 . . . . 10.0 111.075 176.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 73.4 m95 -89.47 -32.02 17.41 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.32 1.448 . . . . 10.0 112.355 -177.038 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -49.18 -57.45 11.57 Favored Pre-proline 0 CA--C 1.542 0.667 0 O-C-N 120.461 -1.4 . . . . 10.0 114.609 175.509 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -65.72 -1.33 4.8 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 122.609 2.206 . . . . 10.0 113.209 178.617 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.5 mmt85 -101.14 -55.16 2.62 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.987 1.315 . . . . 10.0 108.513 176.806 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -60.07 -13.73 13.15 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.725 1.61 . . . . 10.0 114.472 175.827 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -86.11 -38.84 17.34 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 124.363 1.065 . . . . 10.0 109.422 -174.135 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.49 -45.56 37.63 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.549 -0.75 . . . . 10.0 110.932 174.594 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 161.92 -136.32 4.32 Favored Glycine 0 CA--C 1.533 1.158 0 N-CA-C 110.822 -0.911 . . . . 10.0 110.822 -178.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 67.0 t -139.61 -57.53 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 122.524 1.154 . . . . 10.0 111.048 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -43.33 -36.78 1.99 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.281 1.832 . . . . 10.0 112.988 170.949 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -47.21 -27.32 1.45 Allowed 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.822 1.045 . . . . 10.0 113.822 173.883 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.454 ' HB3' ' CMA' ' A' ' 90' ' ' HEC . 1.1 mm? -100.45 -38.48 8.39 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 125.206 1.402 . . . . 10.0 111.471 179.535 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -53.26 -36.81 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 CA-C-N 118.912 0.778 . . . . 10.0 110.285 170.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.9 ptmt -63.72 -44.24 94.17 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.145 1.165 . . . . 10.0 114.145 171.446 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.7 m -64.46 -33.96 77.1 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 120.91 -1.119 . . . . 10.0 110.241 178.669 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.6 t -62.42 -55.0 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 123.736 0.814 . . . . 10.0 112.072 176.328 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.82 -36.97 65.56 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.762 0.315 . . . . 10.0 111.617 177.28 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 21.7 m -71.13 -34.67 71.26 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.945 0.898 . . . . 10.0 111.79 -177.802 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 75.4 112.32 0.1 Allowed Glycine 0 C--N 1.339 0.701 0 N-CA-C 110.596 -1.002 . . . . 10.0 110.596 -167.951 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.0 tp -68.9 -170.48 0.23 Allowed 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 121.501 0.667 . . . . 10.0 109.708 167.232 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -68.09 -61.01 2.05 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 119.559 -1.963 . . . . 10.0 112.023 -167.323 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.97 -40.85 83.07 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.789 1.236 . . . . 10.0 112.041 172.154 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.8 ttt -74.45 120.85 83.47 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 126.572 1.949 . . . . 10.0 112.594 -174.005 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -63.5 156.9 53.92 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.264 1.976 . . . . 10.0 111.712 -177.558 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -57.87 141.85 96.09 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 123.296 2.664 . . . . 10.0 110.475 178.143 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.23 22.01 72.42 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 120.177 -1.011 . . . . 10.0 113.451 -175.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.96 29.48 4.53 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 124.435 1.017 . . . . 10.0 114.462 -176.422 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.9 ttt 75.01 23.87 1.59 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.115 1.766 . . . . 10.0 114.382 -178.057 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.5 t -95.26 155.9 16.54 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 121.107 -0.995 . . . . 10.0 113.228 -179.086 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 41.4 m -69.75 -82.22 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.125 0.97 . . . . 10.0 112.552 178.627 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -125.49 43.12 3.13 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.421 1.088 . . . . 10.0 110.61 -176.711 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.27 126.96 29.74 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.224 -0.922 . . . . 10.0 111.658 -179.174 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.5 m -97.66 -83.49 0.4 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.544 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -156.08 -53.75 0.08 Allowed 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 127.278 2.231 . . . . 10.0 110.162 179.9 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -51.93 -42.53 62.87 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.08 0.552 . . . . 10.0 111.413 178.018 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -47.43 45.84 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 106.977 -1.49 . . . . 10.0 106.977 -178.045 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.24 -52.7 63.68 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.789 1.636 . . . . 10.0 111.798 -173.545 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -66.92 -42.31 85.58 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 125.055 1.342 . . . . 10.0 109.083 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.6 -35.46 63.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.448 1.022 . . . . 10.0 112.772 170.746 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.9 -47.01 49.49 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 120.293 -1.504 . . . . 10.0 111.099 177.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.1 mt -63.61 -37.61 80.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.982 1.313 . . . . 10.0 112.309 177.148 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -71.42 -30.33 65.94 Favored 'General case' 0 C--O 1.231 0.088 0 C-N-CA 124.606 1.162 . . . . 10.0 111.152 176.411 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -53.44 -30.09 38.76 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 112.927 0.714 . . . . 10.0 112.927 171.288 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 71.0 mtm -90.09 -72.72 0.55 Allowed 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.628 -0.67 . . . . 10.0 112.629 178.692 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.49 37.73 0.24 Allowed 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.765 -0.584 . . . . 10.0 112.497 176.24 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.7 ptmt 40.66 56.5 2.79 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 126.057 1.743 . . . . 10.0 114.665 172.489 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -159.72 -78.35 0.06 Allowed 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 124.371 1.068 . . . . 10.0 111.357 170.211 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.242 0.666 0 N-CA-C 113.003 0.742 . . . . 10.0 113.003 -176.602 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . 0.454 ' CMA' ' HB3' ' A' ' 42' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 118.627 -0.701 . . . . 10.0 110.448 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . 0.446 ' OD2' ' NZ ' ' A' ' 9' ' ' LYS . 3.4 p-10 -163.51 41.97 0.1 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 122.247 1.022 . . . . 10.0 111.014 -171.723 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.27 74.32 1.09 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 127.749 2.419 . . . . 10.0 108.737 179.211 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -114.82 -21.1 10.32 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 114.848 1.425 . . . . 10.0 114.848 172.781 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -156.52 120.49 4.37 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.613 0.721 . . . . 10.0 109.605 179.85 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -43.97 -39.14 3.87 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 114.741 1.386 . . . . 10.0 114.741 170.158 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -56.62 -47.95 78.53 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 121.874 -0.516 . . . . 10.0 110.51 172.365 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.23 -33.09 73.76 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.837 -0.539 . . . . 10.0 110.87 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 12.8 mm -65.17 -52.07 57.62 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 176.147 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.57 -41.78 79.23 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 118.144 -1.422 . . . . 10.0 111.438 -178.244 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -68.79 -22.64 64.26 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.08 1.352 . . . . 10.0 112.473 -176.756 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.446 ' NZ ' ' OD2' ' A' ' -2' ' ' ASP . 0.5 OUTLIER -94.42 -28.41 15.52 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.081 1.141 . . . . 10.0 114.081 168.676 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.23 -63.84 1.25 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.14 0.976 . . . . 10.0 113.005 -171.749 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.4 35.6 0.15 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.198 1.399 . . . . 10.0 111.04 -178.303 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.4 t -124.94 -1.57 7.81 Favored 'General case' 0 N--CA 1.46 0.054 0 C-N-CA 124.97 1.308 . . . . 10.0 113.779 -163.74 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.2 t -104.56 -47.83 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 124.783 1.233 . . . . 10.0 108.957 -173.016 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.5 m -84.33 -65.53 1.0 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.186 1.395 . . . . 10.0 110.717 172.05 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -74.4 -20.81 59.92 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.169 1.544 . . . . 10.0 115.169 -163.004 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m -64.73 -44.64 89.5 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 118.392 0.542 . . . . 10.0 110.979 176.845 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.8 mmt -102.17 -22.88 14.11 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.819 1.247 . . . . 10.0 111.899 -177.057 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.13 41.7 6.96 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.094 0.854 . . . . 10.0 111.931 -175.169 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 84.7 t -87.6 159.81 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 124.459 1.104 . . . . 10.0 109.417 179.076 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.63 16.17 5.21 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.938 1.295 . . . . 10.0 113.571 -174.342 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.92 16.18 80.24 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.212 0.91 . . . . 10.0 113.361 -172.803 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.78 132.79 94.0 Favored Pre-proline 0 CA--C 1.544 0.721 0 CA-C-N 118.649 1.224 . . . . 10.0 113.339 -174.55 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.11 140.85 61.25 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.788 2.992 . . . . 10.0 111.206 -178.589 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.36 145.21 55.97 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.809 0.814 . . . . 10.0 112.353 -166.712 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.9 p -51.34 -37.64 48.91 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.39 1.076 . . . . 10.0 113.275 176.455 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -122.19 40.88 3.54 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.398 1.258 . . . . 10.0 114.398 -174.598 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -85.03 165.35 17.61 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.425 -0.797 . . . . 10.0 112.099 174.103 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.2 t -104.34 -34.94 8.13 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.427 0.291 . . . . 10.0 111.415 165.663 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.43 -33.64 60.94 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 120.787 -1.195 . . . . 10.0 113.035 -174.689 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -73.15 -28.9 62.5 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.105 0.479 . . . . 10.0 110.366 179.305 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 69.7 m95 -91.67 -35.46 14.18 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.764 2.026 . . . . 10.0 110.938 -174.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -40.28 -63.17 0.76 Allowed Pre-proline 0 CA--C 1.547 0.832 0 N-CA-C 115.038 1.496 . . . . 10.0 115.038 174.173 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -66.19 -6.12 13.98 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.867 2.378 . . . . 10.0 113.497 -178.664 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.5 mmt85 -98.98 -45.63 5.89 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.977 1.711 . . . . 10.0 108.994 -177.916 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -24.39 63.51 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.818 2.047 . . . . 10.0 110.702 177.556 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.47 -28.53 52.36 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.366 1.066 . . . . 10.0 109.747 176.378 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt -77.38 -52.5 9.04 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.5 0.32 . . . . 10.0 110.519 172.654 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.436 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 164.63 -106.8 0.28 Allowed Glycine 0 CA--C 1.531 1.061 0 C-N-CA 123.558 0.599 . . . . 10.0 111.75 172.823 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.445 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -153.83 -61.58 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 C-N-CA 123.971 0.908 . . . . 10.0 109.413 177.405 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -72.6 24.52 0.06 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.035 1.334 . . . . 10.0 113.242 -171.53 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.445 ' H ' ' C ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -106.57 -25.64 11.73 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 127.705 2.402 . . . . 10.0 108.822 -176.767 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -99.52 -42.48 6.91 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.892 1.277 . . . . 10.0 110.85 178.948 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.7 p -53.25 -35.74 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 122.884 0.474 . . . . 10.0 111.069 171.985 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 ptmt -59.93 -43.6 94.85 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.717 -1.239 . . . . 10.0 112.419 171.767 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.7 m -72.46 -33.78 67.27 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.692 -0.63 . . . . 10.0 110.72 -176.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -47.57 85.62 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 O-C-N 122.067 -0.396 . . . . 10.0 111.197 172.617 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -30.8 71.11 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.788 0.328 . . . . 10.0 111.725 177.005 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.89 -35.95 64.72 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.535 0.939 . . . . 10.0 113.535 179.386 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.47 109.25 0.53 Allowed Glycine 0 CA--C 1.529 0.947 0 N-CA-C 111.254 -0.738 . . . . 10.0 111.254 -167.175 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.71 -154.79 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.139 0.975 . . . . 10.0 109.147 168.959 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -73.04 -66.53 0.66 Allowed 'General case' 0 N--CA 1.479 0.978 0 O-C-N 119.231 -2.168 . . . . 10.0 111.557 -174.875 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.35 -21.48 61.3 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.329 1.052 . . . . 10.0 111.801 174.396 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.4 mtm -84.87 125.2 71.44 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 112.525 0.565 . . . . 10.0 112.525 -179.668 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.51 150.09 69.27 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.063 1.842 . . . . 10.0 111.194 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -60.8 115.07 2.44 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 123.342 2.695 . . . . 10.0 109.817 179.669 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 95.5 10.78 56.56 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 121.309 -0.472 . . . . 10.0 113.559 -175.479 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.98 53.49 7.42 Favored Glycine 0 CA--C 1.536 1.391 0 CA-C-N 118.508 1.154 . . . . 10.0 113.233 175.156 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 83.02 -41.02 0.1 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 127.012 2.125 . . . . 10.0 112.588 -176.797 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.0 t -78.88 176.46 9.57 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.677 -0.64 . . . . 10.0 110.857 174.437 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.0 p -125.17 -73.59 0.63 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.912 1.285 . . . . 10.0 108.282 167.644 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -79.02 58.99 2.56 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.632 1.973 . . . . 10.0 110.439 -179.112 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 25.6 m -109.4 143.82 38.44 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.196 0.998 . . . . 10.0 112.729 169.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 98.8 m -125.83 151.09 47.28 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 125.389 1.476 . . . . 10.0 109.922 -178.781 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -39.59 -38.41 0.6 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.7 2.0 . . . . 10.0 114.82 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -35.33 -53.24 0.64 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.867 1.267 . . . . 10.0 114.349 168.362 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -99.63 -26.51 14.06 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.515 1.526 . . . . 10.0 113.274 171.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -50.38 40.9 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.391 -1.443 . . . . 10.0 110.665 -176.187 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.9 tttt -67.58 -50.71 57.04 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 123.794 0.838 . . . . 10.0 108.909 179.606 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.11 -26.08 2.51 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.512 0.93 . . . . 10.0 113.512 173.413 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.69 -39.38 20.24 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.893 1.277 . . . . 10.0 110.676 -179.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 3.5 mt -72.85 -45.99 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 125.456 1.502 . . . . 10.0 111.789 177.651 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.84 -26.61 67.74 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.434 1.094 . . . . 10.0 112.73 177.229 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -53.43 -28.54 30.57 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.399 0.889 . . . . 10.0 113.399 169.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 62.7 mtm -87.59 -78.05 0.32 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.69 0.796 . . . . 10.0 112.104 179.676 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.4 t -153.37 37.61 0.48 Allowed 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.823 -0.548 . . . . 10.0 111.588 176.255 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt 32.78 66.14 0.21 Allowed 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.532 1.933 . . . . 10.0 114.915 174.669 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.09 -53.86 0.06 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.419 0.896 . . . . 10.0 113.419 -176.959 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.506 ' NZ ' ' OXT' ' A' ' 78' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.604 0 C-N-CA 126.15 1.78 . . . . 10.0 111.344 -179.704 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 117.96 -1.019 . . . . 10.0 110.048 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -163.34 55.68 0.18 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 122.191 0.995 . . . . 10.0 110.702 -168.862 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -129.68 39.8 3.67 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 124.601 1.161 . . . . 10.0 112.734 -178.827 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -99.07 -23.94 15.08 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.625 0.972 . . . . 10.0 113.625 -175.405 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -142.98 128.78 19.37 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.112 -1.07 . . . . 10.0 108.112 171.754 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -52.87 -38.31 61.45 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.44 1.096 . . . . 10.0 112.983 172.128 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -56.61 -48.7 76.9 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.781 0.324 . . . . 10.0 110.275 170.206 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.91 -32.22 70.42 Favored 'General case' 0 CA--C 1.528 0.103 0 O-C-N 121.696 -0.627 . . . . 10.0 111.72 -177.611 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 36.0 mt -64.76 -52.96 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 N-CA-C 107.328 -1.36 . . . . 10.0 107.328 176.252 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.417 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -69.38 -42.52 75.06 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 117.934 -1.506 . . . . 10.0 111.457 -176.298 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -70.49 -24.03 62.78 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.689 1.595 . . . . 10.0 113.148 -176.618 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.14 -31.29 19.24 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.12 0.873 . . . . 10.0 111.984 167.604 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.408 ' C ' ' H ' ' A' ' 12' ' ' THR . . . -102.4 -68.23 0.84 Allowed 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 114.094 1.146 . . . . 10.0 114.094 -171.773 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.417 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.82 41.12 0.34 Allowed 'General case' 0 CA--C 1.554 1.107 0 CA-C-O 123.176 1.465 . . . . 10.0 109.238 -174.922 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.408 ' H ' ' C ' ' A' ' 10' ' ' ALA . 7.0 t -123.99 -10.23 7.67 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 126.34 1.856 . . . . 10.0 112.701 -164.644 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 49.2 t -92.97 -51.62 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 C-N-CA 125.401 1.48 . . . . 10.0 108.102 -177.215 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.7 m -95.14 -57.12 2.51 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.701 1.601 . . . . 10.0 109.816 -171.771 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -73.15 -23.98 60.53 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.001 0.92 . . . . 10.0 112.914 -169.789 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.7 t -62.46 -40.43 96.61 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.799 0.809 . . . . 10.0 111.332 -173.802 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.3 tpt -118.77 -32.49 4.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.564 1.545 . . . . 10.0 112.337 -178.198 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.82 58.9 1.55 Allowed Glycine 0 CA--C 1.534 1.252 0 C-N-CA 124.704 1.145 . . . . 10.0 113.343 -176.687 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 96.0 t -82.35 -57.44 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 O-C-N 121.637 -0.92 . . . . 10.0 112.625 -176.581 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.05 31.22 0.38 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.035 0.934 . . . . 10.0 111.113 179.78 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 62.28 25.78 67.03 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 123.763 0.696 . . . . 10.0 112.552 -169.781 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.78 148.22 96.47 Favored Pre-proline 0 CA--C 1.54 0.578 0 O-C-N 122.015 -0.697 . . . . 10.0 111.467 177.079 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -77.62 142.4 20.51 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 123.287 2.658 . . . . 10.0 111.709 -171.15 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.39 130.18 30.58 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.347 1.24 . . . . 10.0 114.347 -172.295 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.0 m -17.33 -74.04 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 128.922 2.889 . . . . 10.0 115.627 -177.843 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -146.16 115.18 6.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 169.499 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -143.79 -175.74 4.7 Favored 'General case' 0 N--CA 1.443 -0.79 0 C-N-CA 124.325 1.05 . . . . 10.0 110.182 176.532 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 t -102.96 -30.0 11.06 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 170.014 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.47 -52.56 64.69 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 119.892 -1.755 . . . . 10.0 114.452 -173.98 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.429 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 9.5 t0 -77.8 -22.07 50.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.319 1.848 . . . . 10.0 110.049 -179.777 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 54.3 m95 -86.74 -25.44 24.7 Favored 'General case' 0 CA--C 1.553 1.088 0 O-C-N 121.134 -0.979 . . . . 10.0 112.485 177.83 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -49.47 -56.91 13.75 Favored Pre-proline 0 CA--C 1.54 0.586 0 O-C-N 120.543 -1.348 . . . . 10.0 113.096 174.874 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -69.7 9.75 0.55 Allowed 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 122.457 2.104 . . . . 10.0 113.612 178.322 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -110.31 -49.97 3.01 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.477 1.511 . . . . 10.0 108.687 173.784 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 16.8 mt -63.43 9.01 0.06 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.51 1.924 . . . . 10.0 114.65 171.043 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -95.93 -29.16 14.32 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.406 1.482 . . . . 10.0 110.6 175.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.9 mmtt -92.47 -54.13 3.92 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.143 0.977 . . . . 10.0 109.968 179.844 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 166.72 -139.69 5.89 Favored Glycine 0 CA--C 1.533 1.167 0 N-CA-C 110.725 -0.95 . . . . 10.0 110.725 -178.543 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 60.5 t -132.75 -63.15 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.418 1.087 . . . . 10.0 109.545 -175.504 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.66 10.15 0.11 Allowed 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 125.98 1.712 . . . . 10.0 114.025 -176.447 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -90.63 -19.55 23.54 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 128.455 2.702 . . . . 10.0 111.48 176.743 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mt -106.48 -41.19 5.35 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.627 1.171 . . . . 10.0 109.028 -171.381 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.5 p -51.53 -37.0 18.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 C-N-CA 123.049 0.54 . . . . 10.0 111.556 168.227 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.3 ptmt -62.79 -39.22 93.56 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.022 -1.049 . . . . 10.0 113.285 171.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.9 m -70.3 -37.65 74.84 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 121.039 -1.038 . . . . 10.0 110.656 -179.67 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 14.2 t -52.88 -53.63 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 124.043 0.937 . . . . 10.0 110.395 172.209 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -35.75 74.09 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.774 0.657 . . . . 10.0 112.774 176.629 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 63.2 m -72.19 -33.3 67.55 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 118.9 -0.571 . . . . 10.0 112.319 -179.378 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.86 85.1 0.5 Allowed Glycine 0 CA--C 1.533 1.17 0 CA-C-N 119.413 1.006 . . . . 10.0 111.215 -174.019 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.44 172.38 0.34 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.655 1.182 . . . . 10.0 111.523 170.307 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -46.85 -57.79 4.57 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.802 -1.186 . . . . 10.0 112.992 -170.767 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -102.13 28.26 5.97 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 113.647 -1.615 . . . . 10.0 110.585 -179.644 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.3 mmm -123.07 129.2 25.05 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.912 1.285 . . . . 10.0 112.484 179.553 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -68.87 157.34 62.23 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.739 2.293 . . . . 10.0 110.825 176.098 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -61.85 132.81 41.52 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.508 2.139 . . . . 10.0 109.31 -178.679 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 53.45 41.12 63.0 Favored Glycine 0 C--N 1.338 0.673 0 C-N-CA 121.504 -0.379 . . . . 10.0 112.929 -178.185 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.47 50.58 10.34 Favored Glycine 0 CA--C 1.532 1.121 0 N-CA-C 112.062 -0.415 . . . . 10.0 112.062 -179.514 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 65.05 36.72 7.19 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.762 1.625 . . . . 10.0 112.808 176.592 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.5 t -126.18 148.74 49.37 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.293 1.037 . . . . 10.0 111.543 175.319 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 25.4 m -81.54 -75.03 0.3 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.259 0.623 . . . . 10.0 111.048 179.407 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -114.27 41.8 2.21 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.879 1.272 . . . . 10.0 111.631 -175.348 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 7.1 m -61.43 136.57 58.08 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.152 -0.968 . . . . 10.0 110.833 171.248 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 28.6 m -107.13 159.04 16.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.985 1.714 . . . . 10.0 108.881 175.775 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -44.26 -43.7 7.49 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.219 1.192 . . . . 10.0 114.219 175.865 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -51.56 -38.03 52.43 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.084 0.401 . . . . 10.0 112.084 176.595 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -85.41 -48.15 9.28 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.922 0.889 . . . . 10.0 111.131 177.039 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.11 -52.44 65.73 Favored 'General case' 0 C--N 1.34 0.157 0 O-C-N 121.338 -0.851 . . . . 10.0 111.572 -175.725 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -61.13 -53.16 60.51 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 -179.563 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.29 -37.12 10.19 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.238 0.829 . . . . 10.0 113.238 170.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.34 -43.22 77.96 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.095 -1.003 . . . . 10.0 112.373 179.901 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 21.8 pt -76.23 -35.34 27.72 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 O-C-N 121.34 -0.85 . . . . 10.0 112.729 177.254 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -67.92 -29.31 68.36 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.535 1.534 . . . . 10.0 111.843 171.56 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -54.35 -50.54 67.2 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.95 -1.093 . . . . 10.0 110.861 169.696 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 70.1 mtm -65.77 -65.09 0.72 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.595 0.358 . . . . 10.0 110.071 178.047 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.8 m -141.66 -87.4 0.16 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.055 -0.35 . . . . 10.0 110.055 175.507 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt 174.34 49.27 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.131 1.772 . . . . 10.0 110.855 -176.598 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -168.4 -83.97 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.563 1.319 . . . . 10.0 114.563 179.58 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.429 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.151 0 N-CA-C 114.457 1.28 . . . . 10.0 114.457 -170.639 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.976 0 CA-C-O 116.957 -1.497 . . . . 10.0 108.388 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . 0.443 ' CG ' ' HZ3' ' A' ' 9' ' ' LYS . 0.5 OUTLIER -163.12 85.38 0.52 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 122.36 1.076 . . . . 10.0 111.416 -168.173 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.62 72.56 1.45 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.545 1.538 . . . . 10.0 110.159 174.999 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -114.28 -19.67 11.18 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 115.137 1.532 . . . . 10.0 115.137 175.684 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -161.81 167.91 24.04 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.498 1.519 . . . . 10.0 107.27 -173.553 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.38 -49.02 13.02 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.645 2.378 . . . . 10.0 112.183 172.862 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -58.3 -45.92 87.07 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-O 121.126 0.488 . . . . 10.0 110.599 -179.398 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.29 -34.38 77.85 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.04 -0.412 . . . . 10.0 109.962 -176.68 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.8 mm -66.45 -50.56 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 118.388 -0.815 . . . . 10.0 110.779 177.009 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.1 -39.26 86.7 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 117.011 -1.876 . . . . 10.0 111.048 179.29 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -69.17 -22.45 63.91 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.482 1.513 . . . . 10.0 113.099 -178.107 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.443 ' HZ3' ' CG ' ' A' ' -2' ' ' ASP . 0.0 OUTLIER -92.61 -29.13 16.3 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.138 0.975 . . . . 10.0 113.175 170.758 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.22 -64.63 1.27 Allowed 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.136 0.974 . . . . 10.0 112.667 -169.286 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.01 42.05 0.24 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.893 1.277 . . . . 10.0 110.896 177.834 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.2 t -126.65 -2.5 6.69 Favored 'General case' 0 CA--C 1.521 -0.146 0 C-N-CA 124.948 1.299 . . . . 10.0 114.067 -163.968 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.8 t -102.78 -52.52 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 124.019 0.928 . . . . 10.0 108.861 -174.256 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.3 m -81.14 -64.91 1.09 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.728 1.611 . . . . 10.0 110.471 175.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 28.8 m-70 -73.65 -13.03 60.93 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.01 1.324 . . . . 10.0 114.534 -163.936 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 t -73.51 -38.92 65.18 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.161 0.584 . . . . 10.0 110.658 -179.101 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.8 tpt -117.87 -34.32 4.22 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.899 1.279 . . . . 10.0 113.001 -177.039 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.9 52.62 2.06 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.687 1.613 . . . . 10.0 113.414 178.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.405 ' C ' ' H ' ' A' ' 21' ' ' GLY . 84.4 t -75.02 -56.15 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 O-C-N 121.702 -0.881 . . . . 10.0 112.585 -174.452 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.91 33.72 0.44 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.74 0.816 . . . . 10.0 111.038 -179.299 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.405 ' H ' ' C ' ' A' ' 19' ' ' VAL . . . 65.04 21.35 67.81 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 124.406 1.003 . . . . 10.0 112.606 -170.809 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.65 140.59 97.5 Favored Pre-proline 0 CA--C 1.546 0.806 0 N-CA-C 113.426 0.899 . . . . 10.0 113.426 -172.559 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -71.56 143.4 42.38 Favored 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 125.217 3.945 . . . . 10.0 111.038 -177.255 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -67.19 145.14 55.54 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.258 -0.901 . . . . 10.0 113.43 -166.136 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 79.0 p -41.03 -40.09 1.36 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.714 1.206 . . . . 10.0 113.442 161.499 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -133.06 122.84 24.73 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.939 1.296 . . . . 10.0 110.511 171.706 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -154.69 170.46 21.5 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.867 2.067 . . . . 10.0 107.727 172.58 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.3 m -110.61 -37.99 5.3 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.644 0.656 . . . . 10.0 111.93 169.366 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.83 -19.72 37.03 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 120.996 -1.065 . . . . 10.0 112.836 -175.946 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -79.1 -35.51 42.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.455 1.902 . . . . 10.0 110.133 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.463 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 70.5 m95 -88.48 -37.87 15.44 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.802 2.441 . . . . 10.0 112.736 -179.695 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -40.01 -59.96 1.6 Allowed Pre-proline 0 CA--C 1.545 0.773 0 N-CA-C 113.983 1.105 . . . . 10.0 113.983 173.696 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.65 22.13 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.073 3.182 . . . . 10.0 114.731 178.895 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -125.98 -47.27 1.65 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.288 1.835 . . . . 10.0 109.854 167.7 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.5 mt -54.81 -5.45 0.09 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.316 1.846 . . . . 10.0 114.154 168.142 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.35 -31.41 48.56 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.194 1.398 . . . . 10.0 109.792 178.245 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.3 mttp -91.31 -57.18 2.87 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.79 0.436 . . . . 10.0 110.515 169.531 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.66 -114.52 0.66 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.255 -0.738 . . . . 10.0 111.255 172.643 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -127.04 175.74 8.45 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.085 0 C-N-CA 125.529 1.531 . . . . 10.0 110.612 176.904 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.9 t70 73.45 -42.15 0.51 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.37 1.468 . . . . 10.0 112.138 -174.381 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -20.22 8.34 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.262 -0.899 . . . . 10.0 113.192 -176.353 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -103.51 -40.65 6.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.676 1.59 . . . . 10.0 111.572 178.988 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -48.27 -35.52 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 124.622 1.169 . . . . 10.0 111.819 167.449 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -66.81 -43.48 83.69 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 120.528 -1.358 . . . . 10.0 114.065 169.115 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.5 m -72.34 -34.12 67.8 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.643 -1.286 . . . . 10.0 111.522 -176.962 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 9.9 p -68.03 -47.16 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 O-C-N 121.612 -0.68 . . . . 10.0 110.967 174.268 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -56.07 -41.97 75.93 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.112 0.414 . . . . 10.0 110.822 -179.904 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 32.7 p -72.86 -35.1 67.14 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.115 0.783 . . . . 10.0 113.115 178.491 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.15 105.59 0.85 Allowed Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.868 0.758 . . . . 10.0 112.562 -174.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.87 170.38 4.32 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.151 0.981 . . . . 10.0 111.621 171.053 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.407 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 5.2 m-80 -52.04 -60.36 3.28 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.583 -1.323 . . . . 10.0 113.419 -169.268 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.51 15.85 1.92 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.692 1.197 . . . . 10.0 112.635 174.167 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.9 ttp -125.39 129.72 24.35 Favored Pre-proline 0 CA--C 1.547 0.84 0 N-CA-C 113.834 1.05 . . . . 10.0 113.834 -175.128 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.16 156.75 53.42 Favored 'Trans proline' 0 CA--C 1.538 0.721 0 C-N-CA 121.492 1.461 . . . . 10.0 111.636 178.758 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -57.48 139.26 89.61 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 122.408 2.072 . . . . 10.0 109.143 177.835 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.32 23.23 59.8 Favored Glycine 0 CA--C 1.528 0.858 0 C-N-CA 121.162 -0.542 . . . . 10.0 114.025 -174.378 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 49.66 37.27 26.83 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.278 1.039 . . . . 10.0 111.266 -174.272 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER 91.55 -27.13 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.487 2.315 . . . . 10.0 112.871 -176.478 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 19.3 t -95.46 69.82 3.07 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.087 -1.008 . . . . 10.0 113.048 -176.864 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.4 m -53.82 -22.06 8.82 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.263 -0.898 . . . . 10.0 113.03 170.322 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -78.57 -24.36 45.6 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 127.005 2.122 . . . . 10.0 112.785 -178.677 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 66.4 m -70.66 144.95 50.92 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.988 -1.07 . . . . 10.0 112.938 -173.536 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 91.3 m -100.54 -91.09 0.31 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.412 0.551 . . . . 10.0 110.526 -174.394 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -152.45 -50.03 0.11 Allowed 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 124.702 1.201 . . . . 10.0 109.57 179.154 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -52.96 -57.84 8.96 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.342 -0.849 . . . . 10.0 112.844 175.625 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -74.16 -28.61 61.39 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.443 1.02 . . . . 10.0 110.23 -179.021 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.28 -53.81 38.49 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.566 1.146 . . . . 10.0 111.206 -177.327 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.0 pttp -62.67 -49.73 73.97 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 107.362 -1.347 . . . . 10.0 107.362 179.426 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.95 -34.94 57.85 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.118 0.567 . . . . 10.0 112.247 175.811 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.51 -49.82 72.02 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.644 -0.66 . . . . 10.0 110.684 177.718 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 7.0 mt -67.65 -40.83 84.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.347 0.594 . . . . 10.0 111.768 176.572 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -57.83 -37.29 73.57 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.928 1.291 . . . . 10.0 111.435 172.804 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -54.26 -44.63 71.97 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.733 0.642 . . . . 10.0 112.733 176.796 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.463 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 1.2 mpp? -69.19 -74.05 0.14 Allowed 'General case' 0 CA--C 1.541 0.613 0 O-C-N 122.095 -0.378 . . . . 10.0 111.902 179.274 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 t -161.0 37.76 0.15 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.246 0.619 . . . . 10.0 112.3 178.496 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.255 2.5 ptpt 42.51 55.36 4.17 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.554 1.942 . . . . 10.0 114.741 174.613 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -158.86 -87.4 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.505 -0.77 . . . . 10.0 112.372 178.437 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.033 0 N-CA-C 115.687 1.736 . . . . 10.0 115.687 -163.512 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.965 0 N-CA-C 108.514 -0.921 . . . . 10.0 108.514 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -164.47 105.11 0.85 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.911 0.862 . . . . 10.0 111.264 -144.424 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 1.6 tp -75.08 69.41 1.97 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.122 0.969 . . . . 10.0 110.257 174.846 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -110.19 -25.02 10.39 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.904 1.282 . . . . 10.0 112.221 174.83 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -147.03 112.69 5.66 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 124.028 0.931 . . . . 10.0 109.072 174.746 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -38.29 -41.64 0.63 Allowed 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.274 1.583 . . . . 10.0 115.274 166.155 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -58.04 -48.29 80.55 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.121 0.873 . . . . 10.0 110.404 171.399 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.22 -33.22 74.9 Favored 'General case' 0 N--CA 1.457 -0.122 0 O-C-N 121.795 -0.566 . . . . 10.0 110.37 -178.228 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 15.9 mm -65.84 -50.79 68.06 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-O 118.46 -0.781 . . . . 10.0 109.94 174.831 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.418 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -67.58 -40.39 84.83 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 117.379 -1.729 . . . . 10.0 111.15 -178.772 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -69.4 -22.68 63.68 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.971 1.708 . . . . 10.0 112.922 -178.704 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -92.69 -29.18 16.2 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.648 1.179 . . . . 10.0 113.206 170.663 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.92 -63.78 1.36 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.443 1.097 . . . . 10.0 112.734 -170.732 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.418 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.51 40.32 0.17 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.908 1.283 . . . . 10.0 111.131 178.962 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -127.6 1.57 6.17 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 114.254 1.205 . . . . 10.0 114.254 -164.158 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.7 t -96.75 -42.38 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 C-N-CA 124.918 1.287 . . . . 10.0 108.399 -179.139 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.2 m -105.33 -58.96 1.82 Allowed 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.666 1.986 . . . . 10.0 109.506 -169.428 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -74.26 -26.21 60.08 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.88 1.067 . . . . 10.0 113.88 -172.267 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.0 m -59.55 -47.86 83.9 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.415 0.686 . . . . 10.0 111.292 -177.961 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.6 tpt -106.83 -23.74 12.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.634 0.773 . . . . 10.0 111.932 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.04 57.99 1.63 Allowed Glycine 0 CA--C 1.535 1.323 0 C-N-CA 123.866 0.746 . . . . 10.0 112.234 -173.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 51.6 t -105.62 161.02 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 125.842 1.657 . . . . 10.0 109.518 -179.836 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 55.89 26.61 9.94 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.253 1.021 . . . . 10.0 112.693 -175.163 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.8 11.09 84.83 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.622 1.106 . . . . 10.0 113.944 -176.46 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.3 142.43 92.44 Favored Pre-proline 0 CA--C 1.548 0.87 0 CA-C-N 118.926 1.363 . . . . 10.0 113.761 -173.172 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -75.13 152.13 39.78 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 125.145 3.897 . . . . 10.0 110.529 -178.416 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.78 141.94 38.57 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -165.809 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.6 p -79.07 50.26 1.02 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.351 1.461 . . . . 10.0 113.43 -179.052 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -146.72 -39.71 0.21 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 115.623 1.712 . . . . 10.0 115.623 177.361 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.88 153.94 39.65 Favored 'General case' 0 C--O 1.226 -0.163 0 N-CA-C 108.211 -1.033 . . . . 10.0 108.211 179.289 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 34.1 m -96.13 -30.17 13.67 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 119.485 1.039 . . . . 10.0 110.267 174.251 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.39 -31.28 63.7 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.787 1.403 . . . . 10.0 114.787 -178.951 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -77.1 -31.41 55.84 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-O 121.792 0.806 . . . . 10.0 111.539 178.055 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.499 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 59.9 m95 -85.99 -33.6 21.04 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.119 2.167 . . . . 10.0 112.266 -178.265 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -46.94 -56.54 11.52 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.35 1.46 . . . . 10.0 113.424 175.5 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.35 14.97 0.21 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.321 2.681 . . . . 10.0 114.016 178.351 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.32 -52.65 2.48 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.014 1.726 . . . . 10.0 109.357 167.073 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.77 -19.2 62.22 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.642 1.577 . . . . 10.0 112.588 -179.204 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.13 -35.27 25.72 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 125.064 1.345 . . . . 10.0 109.601 -178.754 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -72.4 -50.36 27.0 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.175 171.12 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.453 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 162.68 -130.21 2.21 Favored Glycine 0 CA--C 1.533 1.177 0 N-CA-C 111.237 -0.745 . . . . 10.0 111.237 177.298 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.401 ' C ' ' H ' ' A' ' 41' ' ' ASN . 3.1 t -136.29 -58.84 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 123.753 0.821 . . . . 10.0 109.442 -178.01 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.67 11.08 0.06 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.607 1.963 . . . . 10.0 114.285 -177.701 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.453 HD22 ' N ' ' A' ' 38' ' ' GLY . 0.2 OUTLIER -96.43 -20.97 18.04 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 127.104 2.161 . . . . 10.0 110.837 178.577 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -100.26 -41.56 7.03 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.108 0.563 . . . . 10.0 111.352 -178.65 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -52.89 -35.71 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 CA-C-O 121.279 0.562 . . . . 10.0 111.188 172.564 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.3 ptmt -64.77 -43.75 92.25 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.954 1.094 . . . . 10.0 113.954 170.303 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.8 -36.7 81.87 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.017 -1.052 . . . . 10.0 109.78 177.128 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 23.0 t -60.1 -57.89 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.837 0 C-N-CA 123.067 0.547 . . . . 10.0 110.385 176.139 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -55.84 -34.53 65.5 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 112.885 0.698 . . . . 10.0 112.885 177.579 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.5 m -72.05 -35.94 69.47 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 176.014 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.61 109.74 0.54 Allowed Glycine 0 CA--C 1.536 1.384 0 CA-C-N 119.324 0.966 . . . . 10.0 112.16 -173.027 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.55 -174.45 3.39 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.304 1.042 . . . . 10.0 111.412 175.322 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -51.58 -55.37 19.55 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 123.317 1.532 . . . . 10.0 112.973 -167.165 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -113.14 34.2 4.62 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 111.575 -2.557 . . . . 10.0 108.915 -176.758 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 44.9 ttp -138.46 123.75 12.2 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 177.799 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -65.91 160.79 42.41 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 122.688 2.259 . . . . 10.0 111.963 -177.739 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -59.57 127.43 23.67 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.784 2.323 . . . . 10.0 109.891 -178.654 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.64 10.58 85.81 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 114.403 0.521 . . . . 10.0 114.403 -173.16 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 62.18 30.54 76.13 Favored Glycine 0 CA--C 1.54 1.624 0 CA-C-N 119.199 1.499 . . . . 10.0 112.697 -178.761 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 80.25 55.15 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.815 2.046 . . . . 10.0 111.549 176.137 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -127.69 167.24 16.72 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.907 1.683 . . . . 10.0 110.956 178.082 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.2 m -118.02 -89.28 0.59 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.861 0.864 . . . . 10.0 110.528 176.987 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -93.2 66.31 4.03 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.444 1.098 . . . . 10.0 109.148 -176.034 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 53.7 m -120.92 129.14 53.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.119 -0.946 . . . . 10.0 111.606 -170.744 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 81.2 m -125.64 145.77 50.01 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 123.666 0.786 . . . . 10.0 110.789 -172.597 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -32.75 -43.2 0.09 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 128.025 2.53 . . . . 10.0 113.932 176.71 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -28.58 -62.04 0.11 Allowed 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.839 2.056 . . . . 10.0 114.321 164.946 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.82 -28.19 12.58 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.489 1.116 . . . . 10.0 112.178 178.581 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -51.89 -41.58 62.05 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.826 -1.171 . . . . 10.0 112.085 170.753 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 51.4 pttt -62.56 -55.7 24.78 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 107.744 -1.206 . . . . 10.0 107.744 175.681 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.38 -33.22 29.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.809 0.844 . . . . 10.0 111.31 -179.71 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.37 -38.85 78.24 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 123.764 0.826 . . . . 10.0 111.749 -179.284 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 10.4 mt -79.4 -47.3 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.355 1.462 . . . . 10.0 111.036 174.937 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -48.25 -42.66 31.11 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 127.116 2.166 . . . . 10.0 112.049 171.428 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -44.41 -44.47 8.39 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.648 0.779 . . . . 10.0 112.185 175.882 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.499 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 3.2 mpp? -75.32 -70.7 0.41 Allowed 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.696 0.284 . . . . 10.0 111.435 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -161.71 32.59 0.13 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.155 0.798 . . . . 10.0 113.155 -178.923 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 39.42 55.36 2.3 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.088 1.355 . . . . 10.0 113.577 -179.098 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -140.08 -61.85 0.52 Allowed 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.532 -0.758 . . . . 10.0 112.372 178.78 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.436 ' HE3' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.731 0 N-CA-C 115.202 1.556 . . . . 10.0 115.202 -163.967 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 117.066 -1.445 . . . . 10.0 108.85 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -160.85 44.6 0.18 Allowed 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 123.381 1.562 . . . . 10.0 108.994 179.619 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -146.0 74.18 1.37 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 127.28 2.232 . . . . 10.0 107.878 -178.375 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.38 -20.79 10.14 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.131 1.16 . . . . 10.0 114.131 171.677 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -156.61 159.87 38.88 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.529 1.532 . . . . 10.0 107.356 -174.95 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.51 -41.96 26.25 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 128.061 2.545 . . . . 10.0 112.082 179.116 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -57.14 -48.6 78.28 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 121.428 0.632 . . . . 10.0 109.702 175.011 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.91 -33.86 76.51 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.345 -175.63 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.0 mt -65.2 -52.22 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 CA-C-O 118.798 -0.62 . . . . 10.0 109.699 176.221 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.42 -38.12 80.92 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 117.142 -1.823 . . . . 10.0 111.313 -177.975 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -69.22 -22.48 63.87 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.69 1.596 . . . . 10.0 113.134 -179.438 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.94 -28.41 14.69 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.999 0.92 . . . . 10.0 113.241 170.631 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.1 -66.33 1.08 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.439 1.096 . . . . 10.0 112.474 -171.187 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.15 43.24 0.21 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 124.781 1.232 . . . . 10.0 111.127 178.12 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.8 t -129.24 -6.62 4.83 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 125.195 1.398 . . . . 10.0 113.816 -164.886 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.6 t -94.79 -43.98 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 124.052 0.941 . . . . 10.0 108.781 -175.245 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.0 m -104.43 -54.55 2.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 125.671 1.589 . . . . 10.0 109.257 -169.713 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -73.59 -13.41 61.01 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.351 1.46 . . . . 10.0 114.081 -172.896 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.3 t -73.01 -43.25 62.36 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.77 -0.581 . . . . 10.0 110.494 -178.144 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 16.3 tpp -112.18 -37.5 5.02 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.936 1.294 . . . . 10.0 112.999 179.917 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.98 58.98 1.27 Allowed Glycine 0 CA--C 1.534 1.268 0 C-N-CA 125.236 1.398 . . . . 10.0 113.461 -178.591 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 89.7 t -79.8 -60.28 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.615 -0.932 . . . . 10.0 112.711 -175.431 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.47 30.74 0.41 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.716 0.806 . . . . 10.0 111.171 178.884 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.57 6.69 81.72 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 124.348 0.975 . . . . 10.0 113.58 -173.466 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.43 135.83 69.97 Favored Pre-proline 0 CA--C 1.544 0.732 0 CA-C-N 118.07 0.935 . . . . 10.0 112.529 -176.272 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -69.36 149.83 69.93 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.917 3.078 . . . . 10.0 111.111 -175.335 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.427 ' HZ1' ' CE1' ' A' ' 26' ' ' HIS . 0.0 OUTLIER -76.63 134.48 39.3 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.156 0.583 . . . . 10.0 110.871 -163.985 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 94.8 p -39.7 -41.33 1.06 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.006 1.323 . . . . 10.0 114.1 178.142 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.427 ' CE1' ' HZ1' ' A' ' 24' ' ' LYS . 26.6 p-80 -131.94 113.64 13.67 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.033 1.733 . . . . 10.0 109.701 173.094 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -149.53 162.19 40.64 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.927 1.691 . . . . 10.0 107.682 174.167 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 99.5 m -107.53 -37.08 6.29 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.596 0.635 . . . . 10.0 111.686 170.127 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.36 -24.94 39.45 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 121.188 -0.945 . . . . 10.0 112.629 -176.76 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -77.33 -39.0 49.19 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.699 1.6 . . . . 10.0 108.947 177.879 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.406 ' CH2' ' HG3' ' A' ' 78' ' ' LYS . 60.1 m95 -80.87 -34.83 33.39 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.21 1.804 . . . . 10.0 112.427 179.568 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -40.18 -61.1 1.23 Allowed Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 115.033 1.494 . . . . 10.0 115.033 172.798 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -68.42 -4.67 13.38 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.333 2.689 . . . . 10.0 113.897 -179.014 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.0 -47.97 6.74 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.124 0.97 . . . . 10.0 108.652 172.234 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.72 16.76 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.83 1.652 . . . . 10.0 115.277 171.699 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.01 -24.05 22.45 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 120.99 -1.069 . . . . 10.0 110.835 -178.071 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.7 mptt -101.16 -48.78 4.29 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.024 0.93 . . . . 10.0 109.868 173.632 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.5 -124.73 1.85 Allowed Glycine 0 CA--C 1.528 0.855 0 N-CA-C 110.412 -1.075 . . . . 10.0 110.412 172.928 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -117.41 175.48 3.25 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.132 0 C-N-CA 125.316 1.446 . . . . 10.0 110.581 175.601 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 70.79 -45.04 0.6 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.078 1.751 . . . . 10.0 112.035 -174.868 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -44.0 -37.59 3.05 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.503 1.047 . . . . 10.0 111.928 -177.424 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -81.03 -43.6 19.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 125.677 1.591 . . . . 10.0 112.227 -179.715 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.81 -31.7 47.97 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 CA-C-O 121.545 0.688 . . . . 10.0 110.09 175.68 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -60.64 -51.06 70.98 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.579 -0.701 . . . . 10.0 112.284 169.871 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 54.1 m -62.28 -35.8 80.13 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 121.128 -0.983 . . . . 10.0 110.296 178.322 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.6 t -61.77 -54.8 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 C-N-CA 123.246 0.618 . . . . 10.0 111.294 177.413 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.72 -36.28 67.06 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 111.928 0.344 . . . . 10.0 111.928 177.059 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 50.0 m -72.37 -40.9 66.95 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.29 0.636 . . . . 10.0 112.566 178.26 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.32 114.86 0.77 Allowed Glycine 0 CA--C 1.528 0.861 0 N-CA-C 111.048 -0.821 . . . . 10.0 111.048 -168.103 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.91 -163.68 0.11 Allowed 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.436 0.695 . . . . 10.0 110.374 169.199 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -71.06 -62.58 1.34 Allowed 'General case' 0 N--CA 1.471 0.584 0 O-C-N 119.839 -1.788 . . . . 10.0 111.353 -172.445 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.74 -14.93 60.34 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.894 1.278 . . . . 10.0 112.586 173.717 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.8 ttp -102.69 120.79 51.73 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 123.181 0.592 . . . . 10.0 112.134 -172.582 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.33 155.26 70.85 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.079 1.852 . . . . 10.0 112.128 -173.183 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -57.94 130.21 37.14 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.373 2.715 . . . . 10.0 110.461 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.53 29.83 75.44 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 118.458 -1.19 . . . . 10.0 113.968 -172.4 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.4 29.3 3.75 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-N 118.984 1.392 . . . . 10.0 115.688 168.703 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.1 ttt 62.5 35.41 14.64 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.271 1.828 . . . . 10.0 114.195 -173.5 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.7 t -123.91 70.02 1.07 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.763 2.025 . . . . 10.0 109.427 -178.28 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 72.7 p 11.55 -96.42 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 128.82 2.848 . . . . 10.0 115.675 -178.826 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -125.7 54.87 1.47 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.913 1.285 . . . . 10.0 109.475 173.541 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 84.1 m -69.67 134.99 49.33 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.337 -0.852 . . . . 10.0 112.503 -178.655 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.59 140.39 33.86 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.622 1.169 . . . . 10.0 110.069 -178.184 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -39.27 -37.11 0.39 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.666 1.986 . . . . 10.0 113.496 176.711 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -36.39 -59.74 0.62 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.549 1.54 . . . . 10.0 113.539 166.147 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -97.59 -25.43 15.14 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.581 0.752 . . . . 10.0 110.992 179.762 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -54.18 48.96 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 120.826 -1.171 . . . . 10.0 110.612 176.276 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -61.83 -40.63 95.97 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.967 0.907 . . . . 10.0 110.219 -176.426 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -57.89 -30.75 66.12 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.949 -0.47 . . . . 10.0 111.735 171.007 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.77 -40.25 33.74 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 120.781 -1.199 . . . . 10.0 110.526 -173.001 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -43.03 78.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 122.799 0.439 . . . . 10.0 111.055 172.801 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -30.96 71.84 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.524 -0.735 . . . . 10.0 111.636 179.286 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -51.05 -48.23 61.58 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.873 -0.517 . . . . 10.0 112.241 171.454 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -64.51 -47.24 79.64 Favored 'General case' 0 CA--C 1.532 0.26 0 O-C-N 121.734 -0.604 . . . . 10.0 111.496 174.073 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.9 t -164.28 -78.18 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 120.28 -0.568 . . . . 10.0 111.72 175.98 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.3 pttt 163.09 45.03 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.659 2.784 . . . . 10.0 109.501 -176.624 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -152.45 -81.05 0.1 Allowed 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 114.528 1.307 . . . . 10.0 114.528 166.617 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.406 ' HG3' ' CH2' ' A' ' 31' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.254 1.299 0 N-CA-C 117.347 2.351 . . . . 10.0 117.347 -165.816 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 109.47 -0.567 . . . . 10.0 109.47 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -162.01 123.23 2.69 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.532 0.733 . . . . 10.0 110.232 -173.28 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.77 72.56 2.03 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.598 1.189 . . . . 10.0 109.184 173.754 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -106.65 -26.74 11.21 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 125.556 1.542 . . . . 10.0 111.443 179.422 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -143.62 115.11 8.08 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 123.666 0.786 . . . . 10.0 109.177 172.02 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -43.87 -36.99 2.6 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.2 1.185 . . . . 10.0 114.2 167.997 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -54.49 -50.81 66.9 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 118.716 0.689 . . . . 10.0 110.468 170.533 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.74 -34.12 76.21 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 121.878 -0.513 . . . . 10.0 110.173 -175.638 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.2 mm -66.23 -51.05 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-O 118.041 -0.981 . . . . 10.0 110.113 176.42 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -67.59 -40.11 84.79 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 117.353 -1.739 . . . . 10.0 111.115 -179.916 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -69.07 -22.54 64.01 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.362 1.465 . . . . 10.0 112.637 -176.424 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -97.11 -26.66 14.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.443 1.097 . . . . 10.0 113.572 170.863 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -103.26 -68.35 0.84 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.954 1.302 . . . . 10.0 113.042 -175.599 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.65 41.99 0.28 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.469 1.508 . . . . 10.0 110.837 -178.476 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.4 t -126.76 -0.38 6.71 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 124.596 1.158 . . . . 10.0 113.52 -163.683 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 t -104.11 -53.14 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 C-N-CA 125.047 1.339 . . . . 10.0 108.573 -174.609 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.7 m -80.34 -65.8 0.96 Allowed 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.213 1.805 . . . . 10.0 110.192 176.333 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -72.91 -15.75 61.57 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.648 1.179 . . . . 10.0 113.983 -164.425 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.1 t -69.57 -41.24 76.09 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.827 -0.545 . . . . 10.0 110.829 -178.139 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.6 tpt -117.66 -35.76 3.86 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.889 1.276 . . . . 10.0 112.893 -177.468 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.89 56.46 1.31 Allowed Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.199 1.38 . . . . 10.0 113.693 179.927 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 64.0 t -78.49 -55.17 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 O-C-N 121.769 -0.842 . . . . 10.0 112.763 -176.046 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.05 32.83 0.44 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.739 0.815 . . . . 10.0 111.339 -179.076 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 62.0 32.21 81.37 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 123.926 0.774 . . . . 10.0 111.859 -169.914 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.65 148.23 82.39 Favored Pre-proline 0 CA--C 1.543 0.677 0 C-N-CA 123.656 0.782 . . . . 10.0 111.794 179.798 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -71.58 155.04 59.78 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 124.624 3.549 . . . . 10.0 110.481 -179.175 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -79.5 136.63 36.96 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.753 -0.592 . . . . 10.0 111.183 -172.525 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.7 m -37.13 -35.84 0.12 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.783 1.633 . . . . 10.0 114.67 169.742 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.4 p80 -131.81 117.44 18.55 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.374 1.07 . . . . 10.0 109.425 171.268 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -153.33 162.46 41.26 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 106.593 -1.632 . . . . 10.0 106.593 170.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 86.9 m -110.43 -36.35 5.8 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 118.21 0.459 . . . . 10.0 111.642 168.552 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.86 -25.24 37.81 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.289 -0.882 . . . . 10.0 113.046 -175.797 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . 0.436 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 65.1 t0 -79.18 -31.48 43.89 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.983 1.713 . . . . 10.0 109.383 176.057 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.459 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 56.7 m95 -84.02 -34.76 24.23 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.813 1.245 . . . . 10.0 111.285 179.481 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.85 -58.99 2.8 Favored Pre-proline 0 CA--C 1.551 0.984 0 N-CA-C 114.415 1.265 . . . . 10.0 114.415 173.451 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -73.72 6.79 2.64 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.33 2.687 . . . . 10.0 114.065 -178.784 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.614 HH12 ' CGD' ' A' ' 90' ' ' HEC . 0.0 OUTLIER -104.74 -42.0 5.51 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.981 0.912 . . . . 10.0 108.67 169.659 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.89 22.1 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 115.159 1.54 . . . . 10.0 115.159 164.73 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.18 -36.96 14.49 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 120.955 -1.091 . . . . 10.0 110.023 178.768 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -76.35 -54.94 6.04 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.977 174.005 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 136.37 50.76 0.07 OUTLIER Glycine 0 CA--C 1.534 1.261 0 CA-C-O 119.334 -0.703 . . . . 10.0 114.808 168.483 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.9 t 62.03 165.36 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.861 1.264 . . . . 10.0 111.906 -179.67 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 77.41 -50.96 0.54 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.417 1.487 . . . . 10.0 110.738 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -38.23 -41.08 0.57 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.655 1.182 . . . . 10.0 111.942 172.091 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -68.37 -50.89 49.95 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 124.596 1.158 . . . . 10.0 111.293 -179.436 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -50.45 -29.29 6.28 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 C-N-CA 124.321 1.049 . . . . 10.0 112.357 167.541 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.67 -37.36 27.55 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 120.676 -1.265 . . . . 10.0 114.362 173.64 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.5 m -76.0 -16.9 59.89 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.451 1.1 . . . . 10.0 111.421 173.767 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.5 p -89.05 -41.23 13.82 Favored 'Isoleucine or valine' 0 C--N 1.34 0.167 0 O-C-N 121.666 -0.646 . . . . 10.0 111.801 175.119 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -39.3 63.32 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.91 0.862 . . . . 10.0 110.942 177.315 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.5 t -73.34 -39.1 65.48 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.277 1.431 . . . . 10.0 112.243 178.256 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 82.5 99.84 0.47 Allowed Glycine 0 CA--C 1.532 1.124 0 C-N-CA 123.36 0.505 . . . . 10.0 111.99 -174.961 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.6 tp -58.56 168.88 1.03 Allowed 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.947 -0.737 . . . . 10.0 111.693 170.026 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -46.96 -57.96 4.45 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.531 1.532 . . . . 10.0 113.547 -174.336 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.69 14.77 7.87 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 114.367 -1.288 . . . . 10.0 112.538 177.138 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -110.96 153.51 43.78 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 114.795 1.406 . . . . 10.0 114.795 171.678 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -72.58 154.13 54.88 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.564 2.176 . . . . 10.0 110.737 169.327 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -62.09 132.41 39.09 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.641 2.227 . . . . 10.0 108.408 175.783 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 63.11 30.21 76.79 Favored Glycine 0 C--N 1.338 0.648 0 C-N-CA 118.946 -1.597 . . . . 10.0 112.357 179.697 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.57 32.28 2.8 Favored Glycine 0 CA--C 1.541 1.668 0 CA-C-N 118.076 0.938 . . . . 10.0 113.987 -179.121 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.1 ttt 70.19 44.42 0.76 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.019 1.728 . . . . 10.0 113.224 -176.438 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.07 156.32 40.17 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.99 1.316 . . . . 10.0 111.572 178.555 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 49.0 m -112.16 -91.97 0.48 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.275 1.03 . . . . 10.0 109.74 -179.257 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -89.8 66.53 7.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.875 1.27 . . . . 10.0 109.52 178.625 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 62.7 m -117.96 127.24 53.64 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.558 1.143 . . . . 10.0 111.429 -176.126 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 85.6 m -122.57 146.14 47.7 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.75 0.82 . . . . 10.0 109.927 -173.129 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -37.26 -42.45 0.46 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.983 2.113 . . . . 10.0 113.43 -178.406 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -35.87 -53.2 0.74 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.263 1.425 . . . . 10.0 113.905 172.296 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.56 -33.51 10.29 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.741 0.816 . . . . 10.0 111.655 173.823 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.04 -40.13 57.53 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.616 -1.302 . . . . 10.0 112.043 177.981 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.2 pttt -69.1 -48.25 63.09 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 123.387 0.675 . . . . 10.0 109.972 178.053 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.25 -32.34 62.25 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.374 0.534 . . . . 10.0 111.802 175.102 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -67.54 -42.45 82.68 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.985 0.914 . . . . 10.0 109.934 -178.76 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -67.92 -51.83 45.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 125.999 1.72 . . . . 10.0 111.773 173.193 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -58.81 -32.7 69.6 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.236 1.415 . . . . 10.0 111.966 178.057 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -47.3 -50.46 21.59 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.275 0.488 . . . . 10.0 111.845 175.987 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.459 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.2 mpp? -66.73 -45.71 77.79 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.966 0.358 . . . . 10.0 111.966 179.002 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.2 t -162.59 -71.48 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.015 0.526 . . . . 10.0 111.567 176.712 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.2 pttt 160.43 50.11 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.38 2.672 . . . . 10.0 110.972 -175.097 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.1 -80.95 0.05 OUTLIER 'General case' 0 C--O 1.224 -0.282 0 O-C-N 121.271 -0.893 . . . . 10.0 113.043 171.711 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.436 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 6.4 ptpp? . . . . . 0 C--O 1.251 1.158 0 N-CA-C 114.832 1.419 . . . . 10.0 114.832 -178.584 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . 0.614 ' CGD' HH12 ' A' ' 34' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 117.952 -1.023 . . . . 10.0 109.355 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -159.53 127.75 4.98 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.659 0.663 . . . . 10.0 109.797 -155.666 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -74.03 72.04 1.63 Allowed 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.27 1.033 . . . . 10.0 110.303 179.731 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -112.64 -21.58 11.19 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.194 1.798 . . . . 10.0 114.313 178.276 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.469 ' CG ' ' H ' ' A' ' 3' ' ' ALA . 23.1 t70 -134.81 -129.49 0.16 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.591 1.556 . . . . 10.0 111.28 -167.518 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.469 ' H ' ' CG ' ' A' ' 2' ' ' ASP . . . -149.7 -52.2 0.15 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 129.977 3.311 . . . . 10.0 109.112 -173.77 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -57.67 -49.28 77.02 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 121.441 0.639 . . . . 10.0 110.154 174.35 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.61 -30.9 70.61 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.902 -0.499 . . . . 10.0 110.775 -176.11 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.95 -51.5 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 N-CA-C 108.678 -0.86 . . . . 10.0 108.678 -179.835 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.36 -42.84 78.62 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 119.625 -0.83 . . . . 10.0 110.837 178.811 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -67.35 -22.4 65.59 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.002 1.321 . . . . 10.0 111.94 -176.13 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.77 -30.81 16.81 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.015 1.117 . . . . 10.0 114.015 167.303 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.03 -65.64 1.14 Allowed 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.893 1.224 . . . . 10.0 113.147 -171.094 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.28 43.83 0.31 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.146 1.378 . . . . 10.0 110.175 178.412 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.9 t -124.63 -3.25 7.82 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 125.076 1.35 . . . . 10.0 113.803 -166.254 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -103.2 -48.11 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 124.312 1.045 . . . . 10.0 108.554 -174.268 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.4 m -85.09 -66.28 0.91 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.748 1.619 . . . . 10.0 110.757 174.157 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -73.87 -19.37 60.74 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.824 1.416 . . . . 10.0 114.824 -163.22 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.2 t -64.79 -54.83 25.02 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.038 0.535 . . . . 10.0 111.035 175.543 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.7 tpt -97.0 -20.16 18.26 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.725 0.81 . . . . 10.0 112.747 -177.841 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.58 42.67 6.4 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 125.563 1.554 . . . . 10.0 112.3 -173.665 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 15.3 t -81.01 159.28 4.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 O-C-N 121.693 -0.886 . . . . 10.0 109.146 176.505 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.53 19.84 5.65 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.914 1.286 . . . . 10.0 113.37 -174.939 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.6 24.35 76.34 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 123.906 0.765 . . . . 10.0 113.127 -173.476 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.43 145.32 87.67 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 118.596 1.198 . . . . 10.0 113.533 -177.782 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -75.17 145.9 31.41 Favored 'Trans proline' 0 N--CA 1.454 -0.828 1 C-N-CA 125.512 4.142 . . . . 10.0 109.825 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -66.77 152.41 45.56 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-O 122.354 1.073 . . . . 10.0 112.137 -167.048 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.6 p -49.26 -33.18 12.27 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.721 1.608 . . . . 10.0 112.592 167.426 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -142.1 74.14 1.44 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.151 1.38 . . . . 10.0 111.947 -177.335 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 15.5 m-20 -103.41 166.27 10.53 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.767 1.227 . . . . 10.0 108.927 166.928 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.5 t -110.19 -36.03 5.94 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 166.979 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.87 -23.92 41.57 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.654 -1.279 . . . . 10.0 112.535 -176.86 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -79.21 -29.79 42.98 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.165 1.386 . . . . 10.0 110.509 178.455 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 57.7 m95 -89.64 -38.59 13.8 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.322 1.849 . . . . 10.0 111.091 -179.495 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -39.43 -61.97 0.9 Allowed Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 114.709 1.374 . . . . 10.0 114.709 174.961 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.04 -1.82 9.35 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.353 2.702 . . . . 10.0 113.862 -177.572 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 56.1 mmt-85 -98.9 -47.31 5.32 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.486 1.514 . . . . 10.0 108.695 176.665 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.15 -10.16 4.12 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 126.227 1.811 . . . . 10.0 113.656 172.762 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.81 -27.74 58.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.17 1.388 . . . . 10.0 109.503 178.179 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -92.96 -56.87 2.83 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.856 0.463 . . . . 10.0 110.51 169.412 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.435 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 165.47 -122.39 1.07 Allowed Glycine 0 CA--C 1.529 0.928 0 N-CA-C 111.567 -0.613 . . . . 10.0 111.567 179.864 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.3 p -151.4 -56.42 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 117.719 0.759 . . . . 10.0 111.352 -178.777 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.07 1.78 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.999 1.481 . . . . 10.0 114.999 171.748 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.435 HD22 ' N ' ' A' ' 38' ' ' GLY . 1.9 m-80 -69.7 -59.39 2.98 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.085 -1.009 . . . . 10.0 109.806 164.824 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.9 mp -80.09 -20.89 44.05 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.38 -0.825 . . . . 10.0 111.042 -166.436 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.13 -15.68 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 124.285 1.034 . . . . 10.0 112.452 164.005 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -82.57 -35.21 27.36 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.086 -1.009 . . . . 10.0 111.819 168.15 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 7.8 t -69.69 -44.77 69.73 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 123.481 0.713 . . . . 10.0 110.277 177.663 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 3.6 p -58.58 -41.61 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 123.24 0.616 . . . . 10.0 111.632 -179.148 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.427 ' NZ ' ' OD1' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -70.88 -28.51 64.61 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.966 -0.459 . . . . 10.0 111.781 179.505 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.3 m -76.23 -35.09 59.18 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.865 1.266 . . . . 10.0 112.507 172.656 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.72 105.05 0.3 Allowed Glycine 0 CA--C 1.525 0.684 0 C-N-CA 123.727 0.679 . . . . 10.0 111.873 -170.345 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.4 tp -68.07 174.51 3.77 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 122.095 -0.65 . . . . 10.0 110.252 170.338 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.414 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 15.3 m-80 -49.57 -54.75 16.44 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.598 -1.314 . . . . 10.0 113.138 -172.67 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -88.78 16.02 7.44 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.398 1.479 . . . . 10.0 112.95 175.76 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -122.98 142.96 39.42 Favored Pre-proline 0 CA--C 1.545 0.784 0 N-CA-C 115.024 1.49 . . . . 10.0 115.024 175.955 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.64 139.92 41.86 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 121.885 1.723 . . . . 10.0 110.835 177.171 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -60.95 119.91 7.33 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.938 2.425 . . . . 10.0 109.582 177.187 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 86.93 12.65 68.08 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 119.625 -1.274 . . . . 10.0 112.643 -175.343 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 60.29 14.6 34.24 Favored Glycine 0 CA--C 1.54 1.614 0 CA-C-N 119.478 1.639 . . . . 10.0 114.579 171.415 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.4 ttt 41.82 45.62 3.18 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.445 2.298 . . . . 10.0 114.525 -175.357 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.8 p -115.56 24.86 11.23 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.628 1.171 . . . . 10.0 113.388 178.63 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.6 m 65.0 -127.97 0.35 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.699 0.8 . . . . 10.0 110.422 177.087 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -79.29 60.0 2.98 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.826 1.25 . . . . 10.0 110.999 -179.304 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 2.8 m -60.9 96.34 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.995 0.918 . . . . 10.0 112.076 -177.452 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.3 t -88.46 129.66 35.38 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 121.072 -1.017 . . . . 10.0 108.386 176.672 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.427 ' OD1' ' NZ ' ' A' ' 47' ' ' LYS . 5.8 m-20 -38.83 -38.5 0.43 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.979 1.712 . . . . 10.0 113.137 178.514 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -43.4 -59.44 2.13 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.264 1.425 . . . . 10.0 112.23 169.183 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -80.7 -37.4 30.73 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.965 0.888 . . . . 10.0 110.344 -179.231 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.6 -46.88 73.89 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.394 1.078 . . . . 10.0 111.161 -179.3 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.8 pttt -72.77 -47.61 45.25 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 124.386 1.074 . . . . 10.0 108.869 -179.639 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.63 -41.1 21.27 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.73 0.412 . . . . 10.0 111.791 173.727 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.76 -53.78 53.16 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.224 0.609 . . . . 10.0 111.237 179.758 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 31.7 pt -71.65 -31.5 42.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 O-C-N 120.961 -1.087 . . . . 10.0 112.84 179.579 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -58.24 -40.45 81.77 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.409 0.684 . . . . 10.0 111.352 167.478 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -51.82 -43.76 63.25 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.508 0.559 . . . . 10.0 112.508 177.165 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -70.37 0.27 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.909 0.337 . . . . 10.0 111.909 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.2 t -162.45 31.56 0.11 Allowed 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.833 0.679 . . . . 10.0 112.833 -178.973 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.4 ptpt 35.58 51.1 0.64 Allowed 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 115.624 1.713 . . . . 10.0 115.624 178.786 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.17 -49.82 0.94 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.629 0.974 . . . . 10.0 113.629 -176.092 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.7 pttp . . . . . 0 C--O 1.249 1.049 0 CA-C-O 116.606 -1.664 . . . . 10.0 112.08 -177.266 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 110.168 -0.308 . . . . 10.0 110.168 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -161.06 119.95 2.53 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.524 0.73 . . . . 10.0 110.158 -169.45 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.13 65.27 1.49 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.386 0.674 . . . . 10.0 109.722 176.193 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -111.75 -27.71 8.39 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.4 1.48 . . . . 10.0 112.759 176.54 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -152.0 114.58 4.58 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 121.951 0.882 . . . . 10.0 109.32 174.98 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.25 -28.25 57.86 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 114.212 1.19 . . . . 10.0 114.212 174.31 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -56.24 -48.33 76.72 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 119.093 0.86 . . . . 10.0 110.426 166.812 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 -34.55 76.48 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.792 -0.568 . . . . 10.0 110.176 -178.019 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.2 mm -65.49 -51.17 66.8 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 CA-C-O 118.871 -0.585 . . . . 10.0 109.668 176.939 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.409 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -68.11 -41.1 82.29 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 118.176 -1.41 . . . . 10.0 111.014 -178.899 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -69.05 -22.28 64.04 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.363 1.465 . . . . 10.0 112.755 -178.06 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.45 -29.07 16.45 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.31 1.044 . . . . 10.0 113.554 168.559 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.3 -65.08 1.19 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.806 1.185 . . . . 10.0 112.952 -172.192 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.409 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -74.46 39.74 0.13 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.542 1.537 . . . . 10.0 111.322 178.655 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.7 t -126.71 3.34 6.74 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 125.084 1.353 . . . . 10.0 113.676 -165.16 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.3 t -100.91 -38.72 6.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 124.604 1.162 . . . . 10.0 108.685 -177.355 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.3 m -110.28 -58.73 2.03 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 126.263 1.825 . . . . 10.0 109.65 -170.275 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 26.3 m-70 -73.48 -25.7 60.58 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.289 0.848 . . . . 10.0 113.289 -173.394 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.18 -51.27 64.9 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.903 0.881 . . . . 10.0 110.499 -177.393 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -111.44 -23.29 10.84 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.771 1.228 . . . . 10.0 112.358 -177.878 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.83 59.96 1.16 Allowed Glycine 0 CA--C 1.537 1.44 0 C-N-CA 124.381 0.991 . . . . 10.0 112.518 -175.513 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 25.6 t -104.74 159.65 5.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 125.515 1.526 . . . . 10.0 109.638 178.237 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.54 23.08 10.41 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.441 1.096 . . . . 10.0 113.178 -176.08 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.24 10.06 86.46 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.304 0.954 . . . . 10.0 113.468 -174.441 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.51 149.62 98.26 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 118.622 1.211 . . . . 10.0 111.451 179.087 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -76.41 163.94 31.5 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 123.859 3.039 . . . . 10.0 110.09 -177.398 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -71.31 141.04 50.49 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.589 -0.694 . . . . 10.0 111.776 -178.087 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.7 t -35.63 -37.79 0.1 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 127.233 2.213 . . . . 10.0 114.327 171.444 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.4 p-80 -139.57 118.43 12.46 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 108.106 -1.072 . . . . 10.0 108.106 168.812 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -138.19 161.2 37.45 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.299 -1.371 . . . . 10.0 107.299 168.793 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.7 t -106.55 -33.24 7.74 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 117.514 0.143 . . . . 10.0 111.255 169.335 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.84 -36.1 70.07 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 120.412 -1.43 . . . . 10.0 113.485 -179.941 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -80.54 -21.87 41.39 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.033 0.533 . . . . 10.0 110.908 -178.314 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 62.9 m95 -93.87 -34.88 12.96 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.659 1.583 . . . . 10.0 109.945 -178.21 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -41.39 -63.02 0.89 Allowed Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 124.786 1.234 . . . . 10.0 114.296 175.003 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -73.24 5.42 3.15 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.86 2.373 . . . . 10.0 113.975 -178.224 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -106.37 -44.08 4.61 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.476 1.91 . . . . 10.0 109.463 174.081 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.25 12.21 0.47 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.755 2.022 . . . . 10.0 113.191 173.764 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.94 -27.69 28.35 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 125.124 1.369 . . . . 10.0 109.914 177.649 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -90.93 -56.78 3.05 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.142 0.577 . . . . 10.0 110.831 175.218 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 150.32 -124.78 1.81 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 110.949 -0.86 . . . . 10.0 110.949 175.748 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -126.23 177.55 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 125.528 1.531 . . . . 10.0 110.041 176.335 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 7.6 t70 73.8 -43.55 0.55 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.779 1.231 . . . . 10.0 111.614 -171.249 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.32 -48.7 65.28 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 120.691 -1.256 . . . . 10.0 112.537 -174.028 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.7 mt -88.54 -37.67 15.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.603 1.161 . . . . 10.0 111.011 -173.513 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -58.26 -29.19 36.96 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.426 0.631 . . . . 10.0 110.382 171.699 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.4 mtpt -63.86 -52.48 59.85 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 120.395 -1.441 . . . . 10.0 114.243 168.884 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.23 -33.12 70.62 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.155 -0.966 . . . . 10.0 109.872 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.54 -42.03 83.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 115.352 -0.84 . . . . 10.0 111.985 174.954 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -81.82 -25.54 35.08 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.446 0.641 . . . . 10.0 111.71 -177.776 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 54.9 m -73.55 -32.98 64.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.944 0.897 . . . . 10.0 112.312 174.03 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 89.54 124.19 2.51 Favored Glycine 0 C--N 1.343 0.923 0 CA-C-N 119.755 1.161 . . . . 10.0 111.634 -174.194 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.43 -157.54 0.79 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.139 0.976 . . . . 10.0 111.91 176.155 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -68.03 138.48 55.88 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-O 122.524 1.154 . . . . 10.0 109.508 -179.311 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 56.29 18.86 3.58 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 111.516 -2.584 . . . . 10.0 112.003 176.459 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.0 ttp -136.89 121.64 12.64 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 123.993 0.917 . . . . 10.0 111.265 -171.733 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -68.36 143.89 59.84 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 121.602 1.535 . . . . 10.0 111.632 -174.971 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -62.16 113.95 2.11 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.43 2.753 . . . . 10.0 109.618 178.685 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 104.84 20.62 9.76 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 123.488 0.493 . . . . 10.0 112.75 -175.502 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 51.39 34.45 33.97 Favored Glycine 0 CA--C 1.54 1.605 0 CA-C-N 119.286 1.543 . . . . 10.0 114.116 177.434 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.0 ttt 65.16 23.12 12.31 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.15 1.78 . . . . 10.0 113.222 -176.554 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.3 t -121.91 155.61 35.1 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.725 1.21 . . . . 10.0 112.06 -170.732 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 80.2 m -88.49 -66.38 0.92 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.646 0.779 . . . . 10.0 111.139 179.736 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -124.46 63.78 1.1 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.403 1.081 . . . . 10.0 109.416 -177.747 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.0 m -81.54 118.89 23.12 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 121.686 -0.634 . . . . 10.0 110.45 172.01 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 62.2 m -108.28 135.44 49.6 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 108.345 -0.983 . . . . 10.0 108.345 179.707 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -32.38 -46.09 0.12 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.722 2.009 . . . . 10.0 114.477 -179.719 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -28.35 -60.85 0.12 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.682 1.993 . . . . 10.0 113.324 167.779 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.18 -37.14 12.26 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.937 0.895 . . . . 10.0 111.988 173.127 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.67 -39.07 50.03 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.985 -1.072 . . . . 10.0 112.311 -177.373 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.7 ptmt -75.51 -50.62 15.14 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.746 1.219 . . . . 10.0 109.361 178.671 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.87 -30.81 15.5 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.575 0.75 . . . . 10.0 111.955 179.174 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.05 -44.85 94.69 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.546 0.738 . . . . 10.0 111.663 175.257 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 19.0 mt -73.18 -41.22 58.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 126.681 1.992 . . . . 10.0 111.086 177.425 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -63.83 -33.79 76.47 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.583 1.153 . . . . 10.0 111.862 174.836 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -55.13 -34.36 63.66 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 112.496 0.554 . . . . 10.0 112.496 171.282 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 65.6 mtm -86.43 -72.48 0.5 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.709 0.804 . . . . 10.0 112.229 -178.839 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -158.34 34.16 0.24 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.515 0.561 . . . . 10.0 112.515 178.064 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt 42.68 52.28 4.96 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.748 1.619 . . . . 10.0 113.86 172.237 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -158.94 -81.73 0.05 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.481 1.112 . . . . 10.0 112.656 173.233 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.229 0 N-CA-C 115.66 1.726 . . . . 10.0 115.66 -171.058 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.236 0 CA-C-O 119.552 -0.261 . . . . 10.0 111.524 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -166.35 128.52 1.86 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 119.228 -0.415 . . . . 10.0 111.412 -169.42 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . 0.254 0.0 OUTLIER -77.6 61.53 2.35 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 122.631 1.205 . . . . 10.0 111.183 178.554 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -109.91 -20.22 12.83 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.468 0.914 . . . . 10.0 113.468 -178.857 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -146.05 -175.79 4.9 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 105.437 -2.06 . . . . 10.0 105.437 177.04 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -93.58 -44.32 8.26 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 126.215 1.806 . . . . 10.0 112.941 169.023 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -54.41 -37.74 65.42 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.528 0.68 . . . . 10.0 110.163 -177.451 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.94 -28.96 43.79 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.905 0.882 . . . . 10.0 113.087 174.802 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.28 -51.39 43.4 Favored 'Isoleucine or valine' 0 C--N 1.339 0.126 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 179.629 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -68.05 -29.46 68.44 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.363 -0.836 . . . . 10.0 111.035 -176.36 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.11 -23.29 65.82 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 126.072 1.749 . . . . 10.0 114.069 174.063 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 tppt? -100.66 -27.89 13.14 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.357 0.873 . . . . 10.0 113.357 172.174 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.99 -72.3 0.73 Allowed 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 124.988 1.315 . . . . 10.0 110.978 -167.068 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.74 37.3 0.14 Allowed 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.731 1.212 . . . . 10.0 110.667 179.043 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.0 t -120.53 -1.99 10.03 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.023 1.729 . . . . 10.0 114.041 -169.949 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 t -100.87 -39.89 7.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 122.362 1.077 . . . . 10.0 108.491 -174.275 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.0 m -101.09 -63.53 1.13 Allowed 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 128.003 2.521 . . . . 10.0 110.352 -177.709 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.4 m-70 -74.06 -29.15 61.75 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.483 1.29 . . . . 10.0 114.483 -168.693 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.1 m -54.8 -47.26 74.22 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.655 0.782 . . . . 10.0 110.881 178.59 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.4 ttt -116.26 -10.7 11.38 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.035 0.934 . . . . 10.0 112.526 -174.135 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.32 48.31 6.91 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 123.854 0.74 . . . . 10.0 112.85 -178.491 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 86.7 t -88.11 158.14 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 C-N-CA 125.438 1.495 . . . . 10.0 109.055 176.936 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.84 22.49 8.65 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.697 0.999 . . . . 10.0 113.697 -175.204 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.3 8.37 70.24 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 123.694 0.664 . . . . 10.0 113.332 -172.629 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.16 142.47 85.86 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 118.26 1.03 . . . . 10.0 111.713 -178.638 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -73.59 150.08 44.92 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.879 2.386 . . . . 10.0 111.092 -179.329 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.62 151.36 13.89 Favored 'General case' 0 C--O 1.245 0.851 0 CA-C-O 122.455 1.121 . . . . 10.0 112.482 -174.293 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.0 p -56.35 -34.35 66.53 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.104 2.562 . . . . 10.0 112.945 173.795 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -141.05 51.48 1.6 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.8 0.809 . . . . 10.0 112.41 177.275 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -69.64 161.62 29.31 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.133 -0.98 . . . . 10.0 109.948 170.592 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.4 t -107.86 -32.79 7.46 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.874 -0.516 . . . . 10.0 111.543 165.115 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.36 -24.78 39.57 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.42 -1.425 . . . . 10.0 113.587 -177.34 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.66 -18.98 39.12 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.745 1.618 . . . . 10.0 111.6 175.498 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -103.52 -34.19 8.76 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.744 1.618 . . . . 10.0 110.736 -176.853 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -43.29 -57.4 5.41 Favored Pre-proline 0 CA--C 1.545 0.786 0 CA-C-N 119.462 1.028 . . . . 10.0 113.637 170.991 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.12 3.53 3.94 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 122.187 1.925 . . . . 10.0 113.52 -179.308 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.413 ' C ' ' H ' ' A' ' 36' ' ' ALA . 8.0 mmt85 -104.74 -47.89 3.93 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.765 1.626 . . . . 10.0 108.728 178.374 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.0 0.16 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.38 2.272 . . . . 10.0 114.246 168.122 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.413 ' H ' ' C ' ' A' ' 34' ' ' ARG . . . -87.69 -22.28 24.74 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.808 1.243 . . . . 10.0 110.484 175.678 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.9 mtmm -106.16 -63.45 1.26 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.565 0.746 . . . . 10.0 111.056 174.37 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.427 ' N ' HD22 ' A' ' 41' ' ' ASN . . . 156.95 -165.31 33.12 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 111.363 -0.695 . . . . 10.0 111.363 -176.254 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . 0.426 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.3 OUTLIER -100.87 -41.77 9.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 124.329 1.052 . . . . 10.0 111.739 178.671 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.49 10.42 0.06 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.819 2.048 . . . . 10.0 114.694 -177.028 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.427 HD22 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -105.9 -58.06 1.96 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 126.192 1.797 . . . . 10.0 107.099 178.331 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.5 mt -72.46 -30.67 64.78 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.022 -0.99 . . . . 10.0 109.847 -174.392 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 p -60.99 -33.23 54.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-O 121.745 0.783 . . . . 10.0 110.879 171.863 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -69.73 -41.74 74.9 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.236 -0.915 . . . . 10.0 110.609 177.696 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.1 m -63.15 -36.0 82.16 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.458 -0.776 . . . . 10.0 110.317 174.294 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.5 t -60.52 -51.05 77.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 121.145 0.497 . . . . 10.0 111.647 179.375 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -33.61 72.39 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.078 0.466 . . . . 10.0 112.256 176.657 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.1 m -73.38 -33.07 64.84 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.822 0.849 . . . . 10.0 112.048 179.535 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.28 114.82 0.16 Allowed Glycine 0 CA--C 1.528 0.89 0 N-CA-C 111.195 -0.762 . . . . 10.0 111.195 -169.479 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.28 -157.33 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.145 0.978 . . . . 10.0 110.563 167.873 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -72.24 -63.35 1.16 Allowed 'General case' 0 N--CA 1.476 0.848 0 O-C-N 119.367 -2.083 . . . . 10.0 111.388 -175.167 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.72 -19.43 60.24 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.961 1.305 . . . . 10.0 111.742 176.608 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.1 ttp -97.43 120.35 61.03 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 123.405 0.682 . . . . 10.0 111.757 -173.216 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -69.42 155.69 66.35 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 121.715 1.61 . . . . 10.0 111.941 -173.273 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -63.95 117.82 4.8 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.997 2.465 . . . . 10.0 109.515 -177.564 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.08 30.48 9.32 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 120.997 -0.62 . . . . 10.0 112.78 -175.201 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 66.74 -63.53 0.18 Allowed Glycine 0 CA--C 1.534 1.252 0 C-N-CA 126.499 1.999 . . . . 10.0 114.665 174.161 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.8 ttp -171.84 -39.05 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.686 2.394 . . . . 10.0 110.685 171.82 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.51 -31.21 53.35 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 122.097 -0.377 . . . . 10.0 111.782 -178.604 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.8 m 72.76 -62.4 0.47 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.686 1.194 . . . . 10.0 112.592 -178.19 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -79.3 54.28 1.66 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.944 0.898 . . . . 10.0 110.579 -179.215 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.84 121.51 45.25 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.256 1.023 . . . . 10.0 109.718 -175.072 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 m -80.94 149.27 29.45 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.031 0.932 . . . . 10.0 110.53 -174.317 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -49.14 -40.21 31.76 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 120.121 1.328 . . . . 10.0 112.563 179.493 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -55.78 -38.8 70.39 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 113.521 0.934 . . . . 10.0 113.521 173.54 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -84.66 -38.27 20.01 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.876 1.27 . . . . 10.0 111.382 177.245 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -63.38 -55.1 27.21 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.376 -1.452 . . . . 10.0 111.426 178.157 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -48.99 74.43 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 107.573 -1.269 . . . . 10.0 107.573 -175.487 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.2 -31.52 53.21 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.367 0.506 . . . . 10.0 112.367 177.0 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.59 -50.14 53.94 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 119.206 0.912 . . . . 10.0 110.765 177.043 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 8.9 mt -60.54 -41.9 89.5 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.516 1.126 . . . . 10.0 111.701 176.232 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -65.41 -43.69 89.79 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.597 1.959 . . . . 10.0 112.374 175.138 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -55.61 -35.91 66.37 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.705 0.631 . . . . 10.0 112.705 174.501 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 56.2 mtm -76.61 -78.97 0.11 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.015 0.746 . . . . 10.0 113.015 179.787 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.4 t -151.62 37.06 0.58 Allowed 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.353 -0.842 . . . . 10.0 111.113 174.986 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 39.74 58.02 2.13 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.45 1.5 . . . . 10.0 113.5 172.923 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -155.02 -75.82 0.11 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.022 -0.99 . . . . 10.0 113.435 177.783 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.245 0 C-N-CA 125.903 1.681 . . . . 10.0 112.978 -171.339 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.529 0.151 0 N-CA-C 110.548 -0.167 . . . . 10.0 110.548 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -145.02 122.8 11.89 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.987 -0.745 . . . . 10.0 108.987 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -53.86 -39.14 65.41 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.12 0.968 . . . . 10.0 112.573 172.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -58.67 -47.42 84.53 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 110.277 -0.268 . . . . 10.0 110.277 171.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.34 -31.78 72.28 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.426 -0.796 . . . . 10.0 110.688 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.5 mm -66.32 -50.98 63.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-O 118.442 -0.789 . . . . 10.0 110.145 176.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.18 -43.13 78.85 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 117.891 -1.524 . . . . 10.0 111.233 178.486 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.96 -22.57 64.11 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.376 1.47 . . . . 10.0 112.593 -175.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt -91.35 -31.57 16.02 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.408 -0.807 . . . . 10.0 113.178 168.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.48 -65.93 1.11 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.453 1.024 . . . . 10.0 112.506 -169.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.88 40.18 0.14 Allowed 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.088 1.355 . . . . 10.0 111.176 177.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.8 t -123.37 3.45 9.11 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 125.252 1.421 . . . . 10.0 113.779 -165.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 40.8 t -105.98 -46.83 8.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 124.234 1.013 . . . . 10.0 108.597 -174.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.6 m -91.01 -63.98 1.19 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 126.595 1.958 . . . . 10.0 111.471 177.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -73.32 -22.93 60.22 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.493 1.117 . . . . 10.0 113.977 -165.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.67 -53.74 54.82 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.157 0.983 . . . . 10.0 110.543 179.565 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 37.5 mmt -102.1 -23.8 14.02 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.402 1.081 . . . . 10.0 112.135 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.15 49.12 2.92 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 124.25 0.929 . . . . 10.0 112.04 -175.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 79.3 t -93.77 161.39 2.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.29 1.436 . . . . 10.0 109.397 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.07 18.9 6.76 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.456 1.102 . . . . 10.0 113.436 -174.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.3 18.43 76.23 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 124.566 1.079 . . . . 10.0 113.209 -173.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.56 145.53 90.19 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 118.525 1.162 . . . . 10.0 113.725 -172.683 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.88 137.21 17.47 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 125.047 3.832 . . . . 10.0 110.02 -177.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.24 139.69 58.8 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 123.95 0.9 . . . . 10.0 112.567 -163.466 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.5 p -51.31 -32.53 25.51 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.508 1.123 . . . . 10.0 113.249 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -134.2 115.34 14.06 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.694 1.197 . . . . 10.0 109.369 171.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -154.58 166.18 34.14 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 125.521 1.528 . . . . 10.0 108.425 176.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 56.5 m -110.13 -36.01 5.95 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 117.776 0.262 . . . . 10.0 111.637 168.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.49 -21.41 35.52 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.305 -0.872 . . . . 10.0 113.268 -176.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -78.67 -30.56 46.25 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.769 2.028 . . . . 10.0 109.528 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -92.67 -35.42 13.51 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 126.546 1.939 . . . . 10.0 111.849 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -43.18 -56.84 5.95 Favored Pre-proline 0 CA--C 1.549 0.94 0 N-CA-C 115.087 1.514 . . . . 10.0 115.087 175.487 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -67.95 -7.51 19.92 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.739 2.293 . . . . 10.0 113.413 -179.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -93.42 -51.62 4.89 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.684 1.194 . . . . 10.0 109.061 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.473 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.5 OUTLIER -61.77 8.78 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.868 1.667 . . . . 10.0 115.257 169.963 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.34 -37.92 14.53 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.977 0.911 . . . . 10.0 109.443 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -93.05 -38.72 11.48 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.01 0.924 . . . . 10.0 111.313 176.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 157.29 -143.56 9.69 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 111.325 -0.71 . . . . 10.0 111.325 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.9 t -127.04 -60.45 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 C-N-CA 123.734 0.814 . . . . 10.0 110.608 -176.091 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -44.96 -33.55 2.06 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.369 1.868 . . . . 10.0 113.653 176.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -48.34 -24.3 1.18 Allowed 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.101 1.36 . . . . 10.0 113.687 173.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -94.74 -47.04 6.65 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 125.431 1.492 . . . . 10.0 111.387 177.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.553 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.3 OUTLIER -51.96 -34.73 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 CA-C-N 119.434 1.015 . . . . 10.0 111.943 172.961 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -67.62 -44.01 79.03 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.525 -1.36 . . . . 10.0 112.627 169.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.5 m -64.08 -43.0 96.77 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.153 -0.967 . . . . 10.0 110.306 -177.028 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.553 HG12 ' HA ' ' A' ' 43' ' ' VAL . 7.6 p -65.64 -48.84 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 124.268 1.027 . . . . 10.0 111.634 178.429 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.59 -31.93 72.83 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.471 0.653 . . . . 10.0 110.828 176.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.3 m -74.04 -33.91 63.9 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.464 -0.772 . . . . 10.0 112.445 176.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 89.01 113.89 1.31 Allowed Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.587 -1.005 . . . . 10.0 110.587 -169.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.29 -170.03 0.9 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.985 0.514 . . . . 10.0 109.873 165.238 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -66.58 -57.02 8.11 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 119.904 -1.747 . . . . 10.0 111.745 -172.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.68 1.69 28.99 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 113.76 -1.564 . . . . 10.0 112.397 176.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 43.4 mtp -109.67 140.73 22.46 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 112.788 0.662 . . . . 10.0 112.788 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.9 149.19 65.68 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.65 1.567 . . . . 10.0 110.679 174.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -65.58 104.91 0.7 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.38 2.72 . . . . 10.0 110.155 -179.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 110.7 22.44 6.35 Favored Glycine 0 CA--C 1.525 0.7 0 CA-C-O 118.813 -0.993 . . . . 10.0 113.093 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 50.77 33.28 27.14 Favored Glycine 0 CA--C 1.535 1.286 0 CA-C-N 119.222 1.511 . . . . 10.0 114.477 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 6.0 ttm 60.2 29.87 19.37 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.866 1.667 . . . . 10.0 112.764 -176.166 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.6 -177.91 3.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.576 1.95 . . . . 10.0 110.171 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.5 t -145.99 -67.62 0.29 Allowed 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.582 -0.699 . . . . 10.0 110.72 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -105.41 31.22 5.08 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.671 1.188 . . . . 10.0 110.899 -176.113 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 64.8 m -88.92 114.07 25.15 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.768 1.227 . . . . 10.0 111.017 -172.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.4 p -86.3 151.18 23.8 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.433 0.693 . . . . 10.0 110.359 -174.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.79 -35.48 10.12 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 114.059 1.133 . . . . 10.0 114.059 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -49.28 -55.76 11.67 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.537 0.608 . . . . 10.0 111.348 171.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -76.29 -37.01 58.08 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.543 -0.723 . . . . 10.0 110.928 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -52.95 63.14 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 122.043 0.925 . . . . 10.0 111.115 -179.366 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.4 mmmm -64.87 -46.42 81.88 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 124.961 1.305 . . . . 10.0 108.96 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.94 -34.85 60.82 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 174.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.32 -43.5 70.16 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.644 -1.285 . . . . 10.0 111.279 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.23 -44.71 96.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 123.713 0.805 . . . . 10.0 112.051 169.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -76.1 -28.07 57.4 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.763 -1.211 . . . . 10.0 111.681 -175.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -46.87 -50.0 19.35 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.818 0.818 . . . . 10.0 110.716 170.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 72.2 mtm -68.46 -47.78 66.23 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.394 -0.821 . . . . 10.0 111.513 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 t -163.92 -87.41 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.353 0.661 . . . . 10.0 111.298 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt 172.43 53.15 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.825 2.05 . . . . 10.0 110.433 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.473 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -160.55 -85.27 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 114.025 1.12 . . . . 10.0 114.025 176.11 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.612 1.565 . . . . 10.0 115.072 -173.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 . . . . . 0 N--CA 1.457 -0.097 0 N-CA-C 112.621 0.6 . . . . 10.0 112.621 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -148.91 116.66 6.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.667 0.746 . . . . 10.0 110.207 176.767 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.41 -33.06 19.44 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 113.139 0.792 . . . . 10.0 113.139 171.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -55.26 -50.61 69.03 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 118.29 0.496 . . . . 10.0 110.906 169.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.85 -34.21 75.08 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.296 0.638 . . . . 10.0 110.785 -177.337 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.2 mm -65.57 -51.84 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 118.47 -0.776 . . . . 10.0 109.381 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.403 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -68.35 -40.47 81.52 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 120.211 1.369 . . . . 10.0 111.249 -178.465 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -68.68 -22.25 64.38 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.461 1.504 . . . . 10.0 112.615 -178.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.49 -29.54 16.94 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.038 -1.039 . . . . 10.0 113.502 167.294 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -106.62 -66.34 1.02 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.742 1.217 . . . . 10.0 112.442 -168.728 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.403 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -78.67 41.1 0.4 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.962 1.705 . . . . 10.0 109.771 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.8 t -123.21 4.09 9.21 Favored 'General case' 0 N--CA 1.461 0.084 0 C-N-CA 124.485 1.114 . . . . 10.0 112.997 -166.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.7 t -107.0 -53.68 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 C-N-CA 125.097 1.359 . . . . 10.0 108.676 -173.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.6 m -81.43 -62.18 1.73 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.609 1.163 . . . . 10.0 111.629 174.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -73.59 -19.34 60.9 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.967 1.307 . . . . 10.0 114.097 -164.337 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 t -64.92 -46.5 81.4 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.731 0.812 . . . . 10.0 111.032 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.8 mmt -104.56 -27.28 11.97 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.277 1.431 . . . . 10.0 111.88 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.38 52.8 1.8 Allowed Glycine 0 CA--C 1.533 1.174 0 C-N-CA 124.845 1.212 . . . . 10.0 112.156 -176.16 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 40.9 t -96.11 161.33 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.75 1.22 . . . . 10.0 109.786 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.23 16.89 5.25 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.083 1.353 . . . . 10.0 113.755 -176.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 74.95 25.52 69.05 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 123.858 0.742 . . . . 10.0 112.843 -172.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.25 141.56 91.53 Favored Pre-proline 0 CA--C 1.537 0.468 0 CA-C-N 118.384 1.092 . . . . 10.0 112.846 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -68.66 145.24 62.97 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 124.08 3.186 . . . . 10.0 110.754 177.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.6 mtpt -73.75 143.39 46.11 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.116 0.413 . . . . 10.0 112.116 -168.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.9 p -57.37 -26.03 60.39 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.119 0.968 . . . . 10.0 113.222 175.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -132.91 105.73 7.28 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.139 0.976 . . . . 10.0 109.338 171.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -147.09 157.98 43.79 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 106.898 -1.519 . . . . 10.0 106.898 173.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.1 t -104.31 -36.09 7.73 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.03 0.377 . . . . 10.0 110.876 166.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.03 -19.19 52.09 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.313 -1.492 . . . . 10.0 113.97 -176.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -89.75 -23.0 21.9 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.654 1.582 . . . . 10.0 110.398 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.596 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 49.4 m95 -97.82 -32.51 11.67 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.834 1.254 . . . . 10.0 110.591 178.215 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -44.14 -58.17 5.25 Favored Pre-proline 0 CA--C 1.542 0.646 0 N-CA-C 114.615 1.339 . . . . 10.0 114.615 172.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.47 6.85 2.1 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.685 2.257 . . . . 10.0 113.612 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -110.8 -42.51 4.0 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.866 1.666 . . . . 10.0 108.777 178.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.18 2.18 1.26 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.465 1.906 . . . . 10.0 114.232 170.071 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.0 14.57 28.7 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.539 1.136 . . . . 10.0 110.61 177.497 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 24.9 mmtt -125.42 -61.96 1.24 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.104 1.362 . . . . 10.0 110.606 173.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 172.09 -125.44 1.18 Allowed Glycine 0 CA--C 1.53 0.994 0 N-CA-C 110.321 -1.111 . . . . 10.0 110.321 -177.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.81 -55.74 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.299 0 C-N-CA 123.992 0.917 . . . . 10.0 110.6 -179.103 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.13 26.62 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.303 1.441 . . . . 10.0 113.995 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.78 -49.21 3.87 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.318 1.847 . . . . 10.0 107.208 177.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.6 mp -80.18 -35.05 36.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.634 -172.275 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.534 ' HA ' HG12 ' A' ' 46' ' ' VAL . 2.1 p -59.06 -23.76 25.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 124.841 1.257 . . . . 10.0 112.362 171.113 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -78.88 -44.89 21.84 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.359 -0.838 . . . . 10.0 111.321 171.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.22 -42.05 99.21 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.47 -0.769 . . . . 10.0 110.285 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.534 HG12 ' HA ' ' A' ' 43' ' ' VAL . 9.0 p -64.33 -48.2 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 122.901 0.48 . . . . 10.0 110.845 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -33.96 76.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.981 0.42 . . . . 10.0 110.325 177.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.0 m -73.41 -28.94 62.27 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.867 0.691 . . . . 10.0 112.867 175.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.79 119.43 1.42 Allowed Glycine 0 CA--C 1.529 0.918 0 CA-C-N 119.271 0.941 . . . . 10.0 111.126 -172.412 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.8 tp -78.49 -146.09 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 123.918 0.887 . . . . 10.0 110.241 171.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -82.11 -64.06 1.26 Allowed 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.003 -1.686 . . . . 10.0 111.048 -175.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.84 -7.86 56.26 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.677 1.191 . . . . 10.0 112.521 174.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.5 mtp -97.05 135.34 22.02 Favored Pre-proline 0 CA--C 1.538 0.501 0 N-CA-C 113.073 0.768 . . . . 10.0 113.073 178.556 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.03 157.09 55.16 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.189 1.926 . . . . 10.0 110.635 175.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.54 101.83 0.46 Allowed 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.233 2.622 . . . . 10.0 109.989 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 118.7 -0.15 15.51 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 123.681 0.658 . . . . 10.0 112.909 -172.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 75.71 -48.51 2.29 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 118.78 1.29 . . . . 10.0 112.667 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -174.44 -37.21 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.995 2.118 . . . . 10.0 111.366 166.383 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -79.25 177.44 8.83 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.947 0.721 . . . . 10.0 112.947 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 t -128.1 -60.67 1.13 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.998 1.319 . . . . 10.0 111.215 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.35 54.01 1.92 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.586 1.154 . . . . 10.0 111.393 -177.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 18.8 m -110.03 125.72 53.22 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.452 1.501 . . . . 10.0 111.372 -177.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 30.2 m -112.89 137.13 51.72 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.86 1.264 . . . . 10.0 109.776 -177.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -35.31 -46.18 0.35 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.775 2.03 . . . . 10.0 114.055 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -28.92 -64.29 0.1 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.341 1.856 . . . . 10.0 112.733 165.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -90.17 -34.19 15.94 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.284 0.633 . . . . 10.0 111.724 177.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.58 -44.69 56.91 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 120.707 -1.246 . . . . 10.0 112.487 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.16 -48.17 53.37 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.639 0.776 . . . . 10.0 110.6 174.313 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.2 -30.6 7.19 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.473 0.545 . . . . 10.0 112.473 172.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.97 -34.36 57.58 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.539 1.136 . . . . 10.0 111.53 -178.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -75.0 -52.87 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.519 1.128 . . . . 10.0 110.115 175.227 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -64.87 -25.71 68.01 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.513 0.725 . . . . 10.0 112.665 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -40.45 -48.08 2.71 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 121.75 0.786 . . . . 10.0 112.085 169.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.8 mpp? -74.68 -49.34 21.66 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.489 -0.778 . . . . 10.0 112.539 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.452 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 5.5 t -152.72 -89.91 0.05 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.787 -0.625 . . . . 10.0 110.208 175.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 169.17 54.96 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.812 1.645 . . . . 10.0 110.001 -176.039 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -167.22 -87.72 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.328 1.051 . . . . 10.0 113.08 173.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.596 ' HE3' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.285 -0.864 . . . . 10.0 112.414 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 . . . . . 0 N--CA 1.46 0.058 0 N-CA-C 112.028 0.381 . . . . 10.0 112.028 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -139.66 120.36 14.29 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 121.533 0.683 . . . . 10.0 109.463 171.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.24 -36.32 30.6 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.723 0.809 . . . . 10.0 113.089 171.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -59.64 -45.67 91.31 Favored 'General case' 0 C--N 1.343 0.309 0 O-C-N 121.972 -0.455 . . . . 10.0 110.622 171.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.05 -31.97 72.0 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.53 -0.731 . . . . 10.0 111.05 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.2 mm -65.32 -51.78 60.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 O-C-N 121.397 -0.814 . . . . 10.0 108.904 175.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.459 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.15 -42.28 76.18 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 117.87 -1.532 . . . . 10.0 111.905 -178.896 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.83 -22.0 64.26 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.466 1.506 . . . . 10.0 112.443 -177.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -92.04 -29.1 16.76 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.829 1.048 . . . . 10.0 113.829 168.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.91 -64.93 1.22 Allowed 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.218 1.007 . . . . 10.0 112.394 -170.061 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.459 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.56 40.63 0.18 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.222 1.409 . . . . 10.0 111.232 178.429 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.4 t -126.9 -4.09 6.4 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 124.805 1.242 . . . . 10.0 114.101 -165.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.4 t -97.29 -40.58 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-O 122.456 1.122 . . . . 10.0 108.426 -175.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.3 m -104.06 -61.09 1.48 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 126.765 2.026 . . . . 10.0 109.631 -173.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -74.27 -16.7 60.94 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.537 1.31 . . . . 10.0 114.537 -169.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.0 m -69.81 -44.91 69.05 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.692 0.797 . . . . 10.0 110.893 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 tpt -115.05 -30.66 6.29 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.318 1.047 . . . . 10.0 113.039 -175.433 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.38 61.4 1.81 Allowed Glycine 0 CA--C 1.535 1.342 0 C-N-CA 125.533 1.539 . . . . 10.0 113.183 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 67.2 t -81.8 -57.13 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.951 -0.735 . . . . 10.0 112.056 -175.529 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.75 35.4 0.51 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.066 0.947 . . . . 10.0 110.725 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 58.64 27.35 61.24 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 124.686 1.136 . . . . 10.0 113.094 -173.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.52 138.19 96.77 Favored Pre-proline 0 CA--C 1.547 0.863 0 O-C-N 122.042 -0.681 . . . . 10.0 111.943 -177.024 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -68.67 149.7 73.81 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 123.35 2.7 . . . . 10.0 111.025 -174.055 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -70.29 137.6 50.84 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.212 -0.93 . . . . 10.0 112.374 -161.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.4 m -51.53 -25.48 6.74 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.263 1.209 . . . . 10.0 114.263 172.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 -142.5 91.14 2.29 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.637 0.775 . . . . 10.0 110.632 174.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -128.07 171.15 12.14 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.64 1.176 . . . . 10.0 109.166 170.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.6 m -105.36 -33.28 8.23 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 119.37 -0.348 . . . . 10.0 110.925 163.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.91 -38.66 61.77 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.904 -1.122 . . . . 10.0 113.852 -176.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -66.79 -31.02 71.38 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.744 0.783 . . . . 10.0 110.072 177.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.458 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 64.4 m95 -91.79 -34.42 14.59 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.33 2.252 . . . . 10.0 111.982 -171.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -41.16 -61.98 1.17 Allowed Pre-proline 0 CA--C 1.546 0.816 0 N-CA-C 114.094 1.146 . . . . 10.0 114.094 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -71.26 8.79 1.02 Allowed 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 123.08 2.52 . . . . 10.0 114.006 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -113.36 -51.45 2.81 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.019 1.728 . . . . 10.0 108.448 -178.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -21.8 66.65 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.601 1.96 . . . . 10.0 112.053 173.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -79.64 -27.96 40.9 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.153 0.981 . . . . 10.0 110.057 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -76.41 -54.45 6.72 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.226 0.61 . . . . 10.0 109.936 174.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 162.5 -113.61 0.57 Allowed Glycine 0 CA--C 1.53 0.997 0 N-CA-C 111.167 -0.773 . . . . 10.0 111.167 176.224 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -144.09 -57.97 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.31 0 C-N-CA 124.201 1.0 . . . . 10.0 110.572 176.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.89 6.73 0.15 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.007 1.723 . . . . 10.0 113.537 -174.671 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -93.34 -17.87 23.07 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 125.467 1.507 . . . . 10.0 110.702 -178.459 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -106.4 -40.78 5.49 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.907 0.883 . . . . 10.0 110.949 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.9 p -52.16 -35.0 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 CA-C-O 121.087 0.47 . . . . 10.0 110.532 170.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.6 ptmt -62.28 -46.36 89.14 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.815 1.043 . . . . 10.0 113.815 171.035 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 64.0 m -67.09 -32.56 73.79 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 120.886 -1.134 . . . . 10.0 110.287 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.3 t -58.15 -58.02 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 122.839 0.456 . . . . 10.0 111.004 172.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -31.47 63.79 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.73 0.641 . . . . 10.0 112.73 175.892 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.71 -32.07 67.39 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 122.848 0.459 . . . . 10.0 112.097 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 79.13 94.4 0.31 Allowed Glycine 0 CA--C 1.532 1.117 0 N-CA-C 111.473 -0.651 . . . . 10.0 111.473 -174.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.5 tp -63.17 168.85 3.89 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.854 -0.792 . . . . 10.0 111.355 175.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -48.56 -57.64 5.88 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.953 -1.092 . . . . 10.0 113.043 -171.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.15 21.48 8.82 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.421 1.488 . . . . 10.0 112.473 174.66 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 39.3 ttp -126.71 129.64 24.02 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 114.313 1.227 . . . . 10.0 114.313 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -63.15 158.03 46.31 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.481 2.121 . . . . 10.0 112.155 177.379 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -58.96 135.71 68.5 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.703 2.269 . . . . 10.0 110.263 -179.356 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.38 16.11 64.54 Favored Glycine 0 CA--C 1.527 0.841 0 O-C-N 121.742 -0.599 . . . . 10.0 113.872 -174.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 55.63 34.59 60.65 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 118.523 1.162 . . . . 10.0 112.285 -176.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 77.58 44.97 0.08 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.367 1.867 . . . . 10.0 112.529 -176.203 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.2 t -100.46 152.03 20.85 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.095 1.358 . . . . 10.0 110.901 171.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.5 p -108.78 -88.14 0.49 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.315 1.046 . . . . 10.0 110.132 164.093 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -106.14 74.93 1.07 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 126.53 1.932 . . . . 10.0 108.1 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -124.61 139.59 53.73 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.464 1.106 . . . . 10.0 110.514 174.532 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 93.6 m -111.43 153.16 26.51 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.845 1.258 . . . . 10.0 110.148 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -34.45 -45.02 0.21 Allowed 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 127.332 2.253 . . . . 10.0 114.54 176.272 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -41.19 -56.88 2.25 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 119.317 0.962 . . . . 10.0 113.518 170.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.12 -42.73 22.98 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.005 1.322 . . . . 10.0 112.739 175.699 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -55.25 -47.56 75.26 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.073 -1.017 . . . . 10.0 112.05 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 ptmm? -68.58 -52.21 34.24 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 108.442 -0.948 . . . . 10.0 108.442 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.75 -34.55 39.88 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.119 0.567 . . . . 10.0 112.36 177.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -64.2 -50.14 69.26 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.827 0.851 . . . . 10.0 109.811 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 8.9 mt -62.24 -44.15 98.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.181 0.993 . . . . 10.0 111.921 172.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -57.1 -37.92 72.62 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.303 1.441 . . . . 10.0 111.91 175.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -49.47 -43.41 45.04 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.476 0.547 . . . . 10.0 112.476 177.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.458 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -73.29 -69.83 0.4 Allowed 'General case' 0 CA--C 1.537 0.479 0 O-C-N 122.163 -0.336 . . . . 10.0 111.078 179.702 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.1 t -167.27 46.67 0.06 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.625 0.77 . . . . 10.0 111.807 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 37.88 60.71 1.15 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.471 1.508 . . . . 10.0 114.125 175.298 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -162.31 -82.0 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 113.232 0.827 . . . . 10.0 113.232 177.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.13 0 N-CA-C 114.74 1.385 . . . . 10.0 114.74 -173.149 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.531 0.248 0 N-CA-C 113.514 0.931 . . . . 10.0 113.514 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -151.49 115.16 4.88 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.526 0.731 . . . . 10.0 109.415 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -38.42 -43.77 0.86 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.943 1.697 . . . . 10.0 113.749 167.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -60.84 -48.08 83.43 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 117.983 0.356 . . . . 10.0 111.1 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.61 -30.89 71.28 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.509 -0.744 . . . . 10.0 110.461 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -65.63 -52.72 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-O 118.916 -0.564 . . . . 10.0 109.534 176.185 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.15 -40.48 78.17 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 118.161 -1.416 . . . . 10.0 110.858 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -68.66 -21.93 64.42 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.85 1.66 . . . . 10.0 112.738 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.82 -27.25 14.01 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 113.447 0.906 . . . . 10.0 113.447 168.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -103.46 -67.73 0.87 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.198 0.999 . . . . 10.0 112.409 -174.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.54 38.73 0.19 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.276 1.43 . . . . 10.0 111.001 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -120.39 -4.67 9.89 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 124.669 1.188 . . . . 10.0 113.782 -166.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.3 t -100.09 -40.95 8.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.346 1.058 . . . . 10.0 109.167 -169.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 m -99.46 -61.26 1.39 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.292 2.237 . . . . 10.0 110.903 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -73.44 -22.78 60.11 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.181 0.993 . . . . 10.0 113.542 -167.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.4 t -61.63 -52.48 64.17 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.573 0.749 . . . . 10.0 110.989 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -101.42 -22.38 14.57 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.328 1.051 . . . . 10.0 111.775 -179.213 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.04 52.78 2.67 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.702 1.144 . . . . 10.0 111.956 -175.55 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 59.7 t -96.68 160.18 2.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 125.262 1.425 . . . . 10.0 109.494 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 60.68 18.6 8.66 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.197 0.999 . . . . 10.0 113.486 -176.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 82.12 3.89 90.42 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 124.082 0.849 . . . . 10.0 113.444 -173.309 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.49 146.28 64.86 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-N 118.164 0.982 . . . . 10.0 113.394 -174.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -70.5 155.33 63.71 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 123.73 2.954 . . . . 10.0 109.723 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -68.95 139.68 55.06 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 119.825 -0.75 . . . . 10.0 111.573 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -32.24 -45.34 0.11 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.848 2.059 . . . . 10.0 113.45 169.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -139.28 102.14 4.42 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.004 0.922 . . . . 10.0 109.191 170.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -118.03 157.92 25.93 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.059 -1.46 . . . . 10.0 107.059 170.143 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 92.9 m -103.79 -35.49 8.18 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.519 0.6 . . . . 10.0 111.279 171.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.82 -23.64 36.35 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.102 -0.999 . . . . 10.0 113.269 -178.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.435 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 33.0 t0 -87.62 -22.3 24.82 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.072 1.749 . . . . 10.0 110.517 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.448 ' CZ3' ' HB2' ' A' ' 74' ' ' MET . 36.7 m95 -95.39 -35.59 11.68 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.06 1.744 . . . . 10.0 110.803 177.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -40.14 -59.54 1.8 Allowed Pre-proline 0 N--CA 1.476 0.825 0 N-CA-C 114.248 1.203 . . . . 10.0 114.248 170.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.05 17.51 0.33 Allowed 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 123.379 2.719 . . . . 10.0 113.925 -179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.83 -43.49 2.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.426 1.89 . . . . 10.0 110.336 168.495 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.1 -13.02 5.73 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.536 1.934 . . . . 10.0 112.488 174.052 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.62 24.18 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.586 1.155 . . . . 10.0 110.513 176.529 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -77.01 -52.21 9.74 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.144 -0.688 . . . . 10.0 109.144 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 157.66 -116.61 0.73 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.545 1.069 . . . . 10.0 110.594 175.275 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . 0.405 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -149.02 -55.82 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.314 1.046 . . . . 10.0 110.331 174.63 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.442 ' HA ' HG12 ' A' ' 43' ' ' VAL . 0.8 OUTLIER -71.76 28.88 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.265 1.026 . . . . 10.0 113.515 -177.113 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.405 ' H ' ' C ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -101.53 -56.3 2.33 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 128.053 2.541 . . . . 10.0 107.217 176.607 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.65 -26.41 32.18 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.71 -0.662 . . . . 10.0 111.161 -172.725 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.461 HG23 HD13 ' A' ' 71' ' ' ILE . 1.2 p -57.17 -22.6 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 125.578 1.551 . . . . 10.0 111.767 166.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.9 mmpt? -80.62 -38.27 29.56 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.227 0.611 . . . . 10.0 111.728 169.168 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.84 -37.7 64.75 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 120.471 -1.393 . . . . 10.0 110.874 -176.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.442 HG12 ' HA ' ' A' ' 43' ' ' VAL . 10.7 p -61.79 -42.46 94.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.246 1.018 . . . . 10.0 110.544 173.314 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -35.81 76.71 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.143 0.497 . . . . 10.0 109.683 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 28.0 m -73.05 -34.34 66.22 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.153 -0.967 . . . . 10.0 111.88 177.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.54 115.65 3.72 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.457 -1.057 . . . . 10.0 110.457 -168.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.02 -152.9 0.06 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 167.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -81.51 -60.69 2.17 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.652 -1.28 . . . . 10.0 110.428 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.09 -7.21 59.2 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.448 1.499 . . . . 10.0 112.335 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.72 142.59 25.3 Favored Pre-proline 0 N--CA 1.468 0.442 0 N-CA-C 112.236 0.458 . . . . 10.0 112.236 177.344 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.66 148.0 71.04 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.376 2.051 . . . . 10.0 110.753 175.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -66.67 110.22 1.83 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.216 2.611 . . . . 10.0 109.825 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 91.52 35.9 6.74 Favored Glycine 0 C--N 1.338 0.688 0 CA-C-O 119.617 -0.546 . . . . 10.0 111.872 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 28.94 39.38 0.02 OUTLIER Glycine 0 CA--C 1.535 1.33 0 C-N-CA 127.365 2.412 . . . . 10.0 115.661 -172.049 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 62.83 -0.85 0.52 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.844 2.057 . . . . 10.0 115.793 -174.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.6 p -94.02 -29.07 15.4 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.608 1.163 . . . . 10.0 112.541 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 96.7 m 65.54 -71.34 0.08 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.149 1.38 . . . . 10.0 111.97 -178.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -79.63 54.52 1.81 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.22 1.408 . . . . 10.0 109.962 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -94.0 117.28 29.89 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.637 1.175 . . . . 10.0 109.307 -174.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 90.9 m -116.34 129.1 56.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.029 -1.101 . . . . 10.0 108.029 -174.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -37.39 -41.45 0.43 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.93 1.692 . . . . 10.0 112.533 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -35.42 -57.36 0.61 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 114.245 1.202 . . . . 10.0 114.245 169.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -91.94 -34.98 14.26 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.188 0.904 . . . . 10.0 111.25 173.756 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.95 -42.2 85.66 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.5 -1.375 . . . . 10.0 112.559 -170.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -42.73 99.9 Favored 'General case' 0 C--O 1.222 -0.35 0 O-C-N 121.353 -0.842 . . . . 10.0 109.909 174.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.39 -28.8 69.52 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.351 1.06 . . . . 10.0 111.999 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.64 -46.38 38.58 Favored 'General case' 0 C--O 1.223 -0.341 0 O-C-N 121.007 -1.058 . . . . 10.0 109.604 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.461 HD13 HG23 ' A' ' 43' ' ' VAL . 0.9 OUTLIER -61.45 -46.65 96.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 121.514 0.673 . . . . 10.0 111.407 170.667 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . 0.256 0.0 OUTLIER -59.63 -35.38 74.26 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 121.491 -0.756 . . . . 10.0 112.185 -177.866 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -44.61 -41.14 6.36 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.34 0.867 . . . . 10.0 113.34 178.009 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.448 ' HB2' ' CZ3' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -76.72 -67.5 0.69 Allowed 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.113 -0.367 . . . . 10.0 111.713 -177.323 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.0 t -164.07 33.81 0.08 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.696 0.798 . . . . 10.0 112.479 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt 38.23 61.27 1.14 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.863 1.265 . . . . 10.0 114.172 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -149.49 -55.57 0.18 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.073 0.949 . . . . 10.0 112.806 -178.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.435 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.2 0 C-N-CA 125.97 1.708 . . . . 10.0 112.134 -171.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.348 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -139.87 121.53 15.3 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 124.697 1.199 . . . . 10.0 107.996 172.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -44.84 -41.0 6.68 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.114 1.366 . . . . 10.0 113.363 168.281 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -59.51 -47.27 86.15 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.053 -0.405 . . . . 10.0 110.901 171.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.17 -31.3 70.76 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.705 -0.622 . . . . 10.0 111.123 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.3 mt -64.44 -53.12 46.66 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 N-CA-C 107.981 -1.118 . . . . 10.0 107.981 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.43 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.3 OUTLIER -69.69 -41.58 75.24 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 117.836 -1.545 . . . . 10.0 112.085 -177.427 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.78 -21.8 64.32 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.299 1.839 . . . . 10.0 112.566 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.65 -28.56 15.29 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.291 0.848 . . . . 10.0 113.291 168.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -108.05 -64.67 1.19 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.173 0.989 . . . . 10.0 112.652 -170.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.1 41.74 0.3 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.911 1.285 . . . . 10.0 110.552 178.302 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.2 t -126.82 4.04 6.65 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.556 1.142 . . . . 10.0 113.507 -165.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.9 t -109.75 -53.76 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 C-N-CA 125.175 1.39 . . . . 10.0 108.676 -172.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.9 m -79.31 -64.31 1.22 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.856 1.262 . . . . 10.0 110.422 173.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -73.81 -10.39 59.62 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.152 1.781 . . . . 10.0 115.058 -165.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 t -72.01 -48.18 46.57 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.92 0.488 . . . . 10.0 109.968 178.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.3 tpt -106.59 -41.07 5.36 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.155 0.982 . . . . 10.0 112.439 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 96.25 62.47 0.96 Allowed Glycine 0 CA--C 1.536 1.376 0 C-N-CA 125.495 1.522 . . . . 10.0 112.666 -175.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 95.3 t -82.41 -55.99 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 O-C-N 121.854 -0.792 . . . . 10.0 112.027 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.94 32.92 0.43 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.064 0.946 . . . . 10.0 111.079 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 66.33 16.66 65.21 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 124.635 1.112 . . . . 10.0 113.442 -173.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.29 141.46 96.23 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 113.4 0.889 . . . . 10.0 113.4 -174.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.58 138.56 38.68 Favored 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 124.764 3.642 . . . . 10.0 110.717 -176.344 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.4 mttm -69.32 138.54 53.86 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 121.715 -0.616 . . . . 10.0 111.157 -168.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.6 t -47.46 -36.95 10.8 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.076 0.769 . . . . 10.0 113.076 175.138 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -119.8 73.72 0.98 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.646 1.578 . . . . 10.0 111.889 179.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -117.74 159.8 22.4 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.046 -1.034 . . . . 10.0 109.757 171.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 57.6 m -108.33 -35.9 6.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.5 0.32 . . . . 10.0 111.39 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.01 -23.32 31.01 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 121.699 -0.625 . . . . 10.0 112.363 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -80.19 -33.86 37.88 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.859 1.663 . . . . 10.0 109.769 178.036 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.529 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 58.4 m95 -86.41 -35.33 19.8 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.039 1.736 . . . . 10.0 111.772 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -39.61 -59.69 1.56 Allowed Pre-proline 0 CA--C 1.548 0.887 0 O-C-N 120.272 -1.518 . . . . 10.0 114.762 172.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -75.06 15.46 0.74 Allowed 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.617 2.878 . . . . 10.0 113.528 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.615 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -116.57 -45.45 2.8 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.531 1.932 . . . . 10.0 108.176 177.609 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.414 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 1.3 mt -58.18 0.35 0.07 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 127.623 2.369 . . . . 10.0 114.208 168.063 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -84.04 -29.12 27.14 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.218 1.407 . . . . 10.0 110.076 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -94.61 -64.68 1.05 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.865 0.866 . . . . 10.0 109.359 -179.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 129.51 119.97 2.2 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 124.184 0.897 . . . . 10.0 112.127 171.361 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.6 m -38.59 116.06 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 114.214 1.19 . . . . 10.0 114.214 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 138.23 -19.99 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 130.142 3.377 . . . . 10.0 110.819 -169.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.09 -57.51 3.75 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.436 1.017 . . . . 10.0 109.985 172.236 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.2 mp -76.7 -24.06 53.12 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.52 -0.737 . . . . 10.0 111.76 -168.306 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -60.15 -27.37 38.99 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 O-C-N 121.686 -0.634 . . . . 10.0 110.829 170.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.9 mmpt? -67.53 -45.84 74.56 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.347 -0.845 . . . . 10.0 110.761 171.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.9 m -62.08 -36.57 82.08 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.174 -0.953 . . . . 10.0 110.155 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.2 t -58.84 -54.13 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 121.065 0.46 . . . . 10.0 111.177 175.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -33.92 71.67 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.325 0.491 . . . . 10.0 112.325 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 58.7 m -71.56 -27.48 63.19 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.696 0.799 . . . . 10.0 112.852 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 76.67 91.93 0.23 Allowed Glycine 0 CA--C 1.53 0.985 0 CA-C-N 119.336 0.971 . . . . 10.0 112.27 -174.19 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.94 167.99 1.43 Allowed 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 122.056 0.932 . . . . 10.0 111.419 171.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -53.66 -55.3 27.21 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.515 -1.365 . . . . 10.0 112.417 -172.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.15 19.93 2.94 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 113.862 -1.517 . . . . 10.0 112.573 174.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.0 ttp -136.15 134.94 20.49 Favored Pre-proline 0 CA--C 1.546 0.802 0 N-CA-C 114.769 1.396 . . . . 10.0 114.769 -175.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.14 147.66 73.48 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 120.965 1.11 . . . . 10.0 111.553 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -61.5 132.61 41.51 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.251 2.634 . . . . 10.0 109.853 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.65 15.05 81.88 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 119.711 -1.233 . . . . 10.0 112.76 -172.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.09 34.63 6.03 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 118.36 1.08 . . . . 10.0 113.728 -177.061 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 77.18 37.92 0.25 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 126.231 1.812 . . . . 10.0 113.583 -177.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 9.8 t -126.03 164.6 20.5 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.427 1.491 . . . . 10.0 111.65 169.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.0 m -102.88 -64.06 1.11 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.686 1.194 . . . . 10.0 111.62 -178.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -122.56 46.51 2.13 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.893 1.277 . . . . 10.0 110.536 -176.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 5.4 m -71.98 116.02 11.88 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 120.824 -1.173 . . . . 10.0 110.068 172.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 t -85.08 138.85 32.16 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.284 0.634 . . . . 10.0 109.612 172.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -36.73 -40.09 0.25 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.49 1.916 . . . . 10.0 112.46 174.045 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -42.17 -55.17 3.37 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.912 1.285 . . . . 10.0 114.049 170.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -89.45 -33.85 16.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.065 0.546 . . . . 10.0 111.278 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.67 -43.79 65.77 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.417 1.087 . . . . 10.0 111.417 176.672 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -72.45 -45.15 60.88 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.86 1.264 . . . . 10.0 110.159 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -57.68 -33.5 68.41 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.432 -0.793 . . . . 10.0 111.577 174.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.56 -46.66 84.88 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 124.039 0.935 . . . . 10.0 110.561 -176.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 25.0 pt -76.59 -37.99 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 124.061 0.945 . . . . 10.0 112.28 174.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -58.19 -36.74 73.52 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.893 -0.504 . . . . 10.0 112.345 173.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -51.08 -44.96 61.3 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 174.321 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -67.62 -75.01 0.1 Allowed 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.618 0.599 . . . . 10.0 112.618 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -153.75 25.51 0.5 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.11 0.564 . . . . 10.0 111.769 -179.09 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 34.39 61.35 0.55 Allowed 'General case' 0 C--N 1.339 0.143 0 C-N-CA 126.895 2.078 . . . . 10.0 115.696 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.615 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -142.84 -56.76 0.43 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.311 -0.858 . . . . 10.0 112.676 -176.2 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.529 ' HE3' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.954 0 CA-C-O 116.624 -1.655 . . . . 10.0 112.823 -177.83 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 CA--C 1.533 0.312 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -141.17 131.2 24.61 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.159 -1.052 . . . . 10.0 108.159 166.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -46.29 -40.52 11.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.877 1.271 . . . . 10.0 112.783 169.665 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -56.24 -50.53 71.05 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.684 0.394 . . . . 10.0 111.008 171.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.15 -32.25 72.4 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.906 -0.496 . . . . 10.0 110.788 -176.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mt -64.69 -52.66 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 108.566 -0.901 . . . . 10.0 108.566 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.479 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.07 -41.58 77.35 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 117.882 -1.527 . . . . 10.0 112.033 -178.419 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -68.91 -22.13 64.18 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.757 1.623 . . . . 10.0 112.608 -176.527 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.0 tttp -95.77 -28.13 14.91 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.976 0.91 . . . . 10.0 113.35 170.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.5 -65.03 1.18 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.287 1.035 . . . . 10.0 112.318 -171.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.479 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.82 41.43 0.21 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.16 1.384 . . . . 10.0 111.013 178.118 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -125.41 -2.38 7.46 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 114.173 1.175 . . . . 10.0 114.173 -164.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 46.9 t -99.46 -47.99 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 124.574 1.15 . . . . 10.0 108.48 -177.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 89.9 m -95.48 -59.43 1.88 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.696 1.998 . . . . 10.0 110.602 -173.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 -74.44 -17.98 60.7 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 -171.132 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.2 t -62.84 -49.91 73.01 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 122.99 0.516 . . . . 10.0 110.465 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.3 tpt -102.84 -33.78 9.23 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.633 0.773 . . . . 10.0 112.705 176.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 101.45 56.52 0.86 Allowed Glycine 0 CA--C 1.536 1.382 0 C-N-CA 125.078 1.323 . . . . 10.0 111.572 -170.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 82.4 t -98.97 157.74 3.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.631 1.572 . . . . 10.0 109.703 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.15 24.24 11.09 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.448 1.099 . . . . 10.0 112.894 -175.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.18 5.47 87.3 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.124 0.868 . . . . 10.0 113.497 -174.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.87 145.83 77.86 Favored Pre-proline 0 CA--C 1.538 0.484 0 CA-C-N 118.771 1.286 . . . . 10.0 112.545 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -66.11 163.18 32.49 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 C-N-CA 123.599 2.866 . . . . 10.0 109.192 171.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.0 tttp -84.31 149.24 26.2 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 121.624 0.726 . . . . 10.0 110.908 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.7 p -43.28 -70.02 0.12 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.173 1.789 . . . . 10.0 111.4 170.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -103.48 119.98 39.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.823 1.649 . . . . 10.0 108.133 174.085 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -151.76 167.74 27.28 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 126.24 1.816 . . . . 10.0 108.19 171.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.0 m -110.77 -36.21 5.77 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 170.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.36 -14.03 41.85 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.288 -0.883 . . . . 10.0 113.159 -177.008 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -87.25 -27.21 23.07 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.515 1.926 . . . . 10.0 110.191 176.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 83.9 m95 -95.66 -38.84 10.19 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.367 1.867 . . . . 10.0 112.017 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -41.7 -57.86 3.62 Favored Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 114.682 1.364 . . . . 10.0 114.682 173.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.12 1.16 4.24 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.331 2.687 . . . . 10.0 113.949 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -102.93 -43.66 5.46 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.12 1.368 . . . . 10.0 109.237 177.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.5 5.31 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.107 1.763 . . . . 10.0 114.757 165.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.14 -30.69 18.42 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.59 1.156 . . . . 10.0 110.32 176.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -91.34 -54.66 3.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.121 0.568 . . . . 10.0 111.218 174.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 161.34 -123.14 1.18 Allowed Glycine 0 CA--C 1.533 1.186 0 N-CA-C 111.782 -0.527 . . . . 10.0 111.782 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.4 -65.54 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.271 1.029 . . . . 10.0 111.75 -177.447 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.7 15.86 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.871 1.668 . . . . 10.0 115.304 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -93.03 -48.74 6.36 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.401 1.48 . . . . 10.0 108.661 178.152 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.6 mt -81.03 -33.43 33.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 124.325 1.05 . . . . 10.0 110.13 -168.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.4 p -54.59 -32.43 25.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-O 121.651 0.738 . . . . 10.0 111.627 169.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -64.85 -41.71 95.49 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.645 -0.659 . . . . 10.0 110.892 177.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.0 m -67.69 -34.31 76.65 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.52 -0.738 . . . . 10.0 110.338 174.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.0 t -58.38 -52.51 58.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 O-C-N 121.791 -0.568 . . . . 10.0 111.173 175.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.6 -37.45 70.68 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.187 0.44 . . . . 10.0 112.187 174.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -71.87 -33.66 68.57 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.218 0.607 . . . . 10.0 111.972 -177.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.9 97.54 0.25 Allowed Glycine 0 CA--C 1.535 1.285 0 N-CA-C 111.482 -0.647 . . . . 10.0 111.482 -169.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.8 tt -61.54 167.3 3.51 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.845 -0.797 . . . . 10.0 111.197 173.515 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -45.51 -58.89 3.04 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.553 -1.342 . . . . 10.0 113.545 -172.28 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -93.98 19.36 9.16 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.312 1.445 . . . . 10.0 112.859 175.197 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 34.9 ttp -125.23 129.09 24.6 Favored Pre-proline 0 CA--C 1.553 1.084 0 N-CA-C 114.116 1.154 . . . . 10.0 114.116 173.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -63.06 158.29 44.52 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.229 1.953 . . . . 10.0 111.864 176.258 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -60.3 148.16 91.13 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.792 2.328 . . . . 10.0 111.021 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 53.12 31.57 41.21 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-N 115.916 -0.583 . . . . 10.0 113.598 -174.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 42.42 32.45 1.21 Allowed Glycine 0 CA--C 1.543 1.813 0 C-N-CA 124.554 1.073 . . . . 10.0 114.534 -170.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.3 ttm 81.24 27.09 0.2 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.068 2.147 . . . . 10.0 114.896 -176.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.7 t -104.76 165.63 10.94 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 120.857 -1.152 . . . . 10.0 112.172 171.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 29.4 m -100.71 -91.94 0.3 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.788 1.235 . . . . 10.0 109.682 174.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -92.57 46.53 1.25 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.441 1.096 . . . . 10.0 110.7 -173.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.61 115.89 16.78 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.692 -1.255 . . . . 10.0 109.943 175.126 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 93.7 m -80.16 149.82 30.39 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.514 0.725 . . . . 10.0 109.596 174.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -32.77 -55.74 0.37 Allowed 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.123 1.157 . . . . 10.0 114.123 167.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -48.22 -55.47 10.4 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.501 0.72 . . . . 10.0 111.675 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -73.57 -35.68 65.49 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.854 -0.529 . . . . 10.0 111.473 -177.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -56.94 -50.69 71.83 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.751 0.786 . . . . 10.0 110.987 172.104 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -64.58 -50.59 66.64 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.434 1.494 . . . . 10.0 109.544 -177.036 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.64 -39.67 25.02 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.033 0.533 . . . . 10.0 112.022 169.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.09 -47.71 60.75 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 120.862 -1.149 . . . . 10.0 112.186 177.464 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mt -55.94 -48.99 77.8 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 C-N-CA 124.85 1.26 . . . . 10.0 111.431 174.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -24.97 58.29 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.94 -1.1 . . . . 10.0 113.195 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -47.03 -50.63 19.12 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 119.152 0.887 . . . . 10.0 111.295 170.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -70.61 -44.33 67.48 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 178.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -154.2 -77.32 0.11 Allowed 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.928 -0.558 . . . . 10.0 112.35 172.056 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 157.99 58.22 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 128.697 2.799 . . . . 10.0 111.215 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -174.14 -75.96 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.809 1.411 . . . . 10.0 114.809 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.9 pttp . . . . . 0 C--O 1.256 1.415 0 N-CA-C 115.603 1.705 . . . . 10.0 115.603 -174.412 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.294 0 N-CA-C 112.93 0.715 . . . . 10.0 112.93 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -142.05 124.29 15.54 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 107.302 -1.37 . . . . 10.0 107.302 171.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.407 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . . . -50.98 -37.26 43.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 172.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -55.75 -49.57 72.74 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.648 0.658 . . . . 10.0 109.864 172.42 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.64 -33.71 74.48 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.866 0.466 . . . . 10.0 111.106 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.91 -51.31 62.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 107.929 -1.137 . . . . 10.0 107.929 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.411 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -68.93 -42.1 77.22 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 119.615 1.098 . . . . 10.0 111.187 -178.842 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -68.26 -22.23 64.77 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.906 1.282 . . . . 10.0 112.639 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.9 tppt? -93.68 -28.17 16.13 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.485 1.114 . . . . 10.0 113.647 169.222 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -108.71 -68.87 0.89 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.387 1.475 . . . . 10.0 112.777 -171.079 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.411 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.54 45.05 0.38 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.393 1.477 . . . . 10.0 109.683 179.079 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.9 t -128.7 -5.5 5.18 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 125.388 1.475 . . . . 10.0 113.343 -167.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.1 t -101.91 -34.19 3.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 125.269 1.427 . . . . 10.0 109.171 -173.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.2 m -102.57 -63.31 1.17 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.101 2.16 . . . . 10.0 110.947 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -73.41 -24.9 60.33 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 114.062 1.134 . . . . 10.0 114.062 -162.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -58.59 -50.79 72.52 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.281 1.032 . . . . 10.0 111.339 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.6 tpt -105.07 -17.9 14.34 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.661 0.784 . . . . 10.0 112.073 -178.721 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.01 50.17 4.0 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 124.191 0.901 . . . . 10.0 112.17 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 47.0 t -95.51 162.17 2.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 125.344 1.458 . . . . 10.0 109.616 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.84 19.29 8.18 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.632 1.173 . . . . 10.0 113.042 -174.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.9 18.17 79.08 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 124.042 0.829 . . . . 10.0 113.003 -173.144 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.76 148.57 92.54 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 118.52 1.16 . . . . 10.0 112.649 -178.351 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.4 ' CG ' ' HE3' ' A' ' 78' ' ' LYS . 87.0 Cg_endo -76.14 153.3 36.37 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 124.958 3.772 . . . . 10.0 110.272 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -67.69 144.48 55.45 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.83 -172.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.3 m -34.26 -43.11 0.15 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.898 1.679 . . . . 10.0 113.679 169.129 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -143.61 110.31 5.56 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.661 0.743 . . . . 10.0 109.765 173.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -129.05 162.93 26.53 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 106.44 -1.689 . . . . 10.0 106.44 174.749 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 90.2 m -106.17 -36.2 6.97 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.756 0.707 . . . . 10.0 111.157 169.338 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.06 -26.57 59.49 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 120.63 -1.294 . . . . 10.0 112.735 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -90.07 -8.46 51.39 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.864 1.666 . . . . 10.0 110.645 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.441 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 48.5 m95 -110.73 -29.91 7.8 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.699 -1.25 . . . . 10.0 109.884 176.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -39.49 -60.58 1.24 Allowed Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 125.496 1.518 . . . . 10.0 114.292 170.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -67.99 2.4 2.65 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.295 1.997 . . . . 10.0 113.898 -177.008 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -113.51 -47.33 3.0 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.246 1.419 . . . . 10.0 110.48 176.095 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.548 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -63.34 -18.7 63.92 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.731 1.613 . . . . 10.0 112.911 173.862 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.12 -31.38 61.1 Favored 'General case' 0 N--CA 1.457 -0.104 0 C-N-CA 124.648 1.179 . . . . 10.0 109.588 178.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.1 mmtt -77.79 -56.14 4.75 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.313 171.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.09 -114.25 0.65 Allowed Glycine 0 CA--C 1.531 1.039 0 N-CA-C 111.987 -0.445 . . . . 10.0 111.987 173.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.86 168.16 19.64 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.076 0 C-N-CA 125.567 1.547 . . . . 10.0 109.796 175.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.412 ' HA ' HG12 ' A' ' 43' ' ' VAL . 0.7 OUTLIER 76.18 -34.04 0.23 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.331 1.452 . . . . 10.0 112.212 -174.204 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.3 -24.4 54.75 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 120.241 -1.537 . . . . 10.0 114.124 -177.468 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -105.92 -33.9 7.79 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.461 1.104 . . . . 10.0 111.939 -178.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.412 HG12 ' HA ' ' A' ' 40' ' ' ASP . 0.5 OUTLIER -56.53 -35.11 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 121.299 -0.876 . . . . 10.0 109.751 170.402 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.13 -42.72 91.29 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.972 1.101 . . . . 10.0 113.972 168.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.9 m -65.9 -39.5 90.66 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 120.688 -1.258 . . . . 10.0 110.442 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 15.6 t -56.31 -51.75 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.49 0.716 . . . . 10.0 110.811 176.604 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -62.95 -33.83 76.2 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.961 0.726 . . . . 10.0 112.961 176.305 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 85.3 m -72.31 -24.32 61.3 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.211 0.605 . . . . 10.0 112.314 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.28 92.56 0.3 Allowed Glycine 0 CA--C 1.533 1.218 0 CA-C-N 119.298 0.954 . . . . 10.0 112.371 -178.486 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -179.09 1.02 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.215 1.007 . . . . 10.0 111.951 175.58 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -55.97 -54.84 39.98 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 123.557 1.646 . . . . 10.0 111.243 -163.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.93 20.77 10.59 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 128.002 2.521 . . . . 10.0 111.927 176.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -130.75 128.39 22.44 Favored Pre-proline 0 CA--C 1.545 0.76 0 N-CA-C 113.341 0.867 . . . . 10.0 113.341 -177.111 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -70.02 157.76 58.81 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 121.497 1.465 . . . . 10.0 111.13 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -63.83 114.11 2.45 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 123.415 2.743 . . . . 10.0 109.846 -177.311 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 92.61 11.94 58.76 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-O 119.853 -0.415 . . . . 10.0 114.097 -171.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.39 -44.06 2.39 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-N 118.692 1.246 . . . . 10.0 113.486 173.084 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.26 -47.31 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.793 1.637 . . . . 10.0 111.893 172.252 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.68 159.11 26.82 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.211 1.404 . . . . 10.0 111.673 178.296 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 86.2 m -103.6 -64.17 1.12 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.744 1.218 . . . . 10.0 112.041 175.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -80.92 56.62 2.8 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.967 0.907 . . . . 10.0 110.784 -173.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.405 ' HB2' ' CE2' ' A' ' 67' ' ' TYR . 0.0 OUTLIER -101.12 139.72 36.41 Favored 'General case' 0 CA--C 1.527 0.063 0 C-N-CA 124.642 1.177 . . . . 10.0 110.802 -173.73 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.0 m -110.77 143.93 40.53 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.12 0.968 . . . . 10.0 108.971 -176.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -47.09 -36.89 8.79 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 114.056 1.132 . . . . 10.0 114.056 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -51.33 -52.62 43.82 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.229 0.922 . . . . 10.0 111.78 170.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.76 -46.32 54.02 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.957 0.799 . . . . 10.0 110.635 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.405 ' CE2' ' HB2' ' A' ' 62' ' ' CYS . 1.6 m-85 -58.99 -51.66 69.11 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 120.838 -1.164 . . . . 10.0 111.424 -179.007 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -68.01 -45.03 75.17 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 117.673 -1.156 . . . . 10.0 109.271 -177.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.407 ' HB3' ' HB2' ' A' ' 3' ' ' ALA . . . -52.66 -31.3 36.34 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.796 1.18 . . . . 10.0 112.887 169.213 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.74 -36.55 31.89 Favored 'General case' 0 C--O 1.222 -0.342 0 O-C-N 120.694 -1.254 . . . . 10.0 112.1 -177.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.0 mt -74.24 -48.27 37.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 125.154 1.381 . . . . 10.0 111.281 174.015 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -27.75 67.2 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.414 1.086 . . . . 10.0 113.312 175.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 32.4 t80 -46.23 -38.72 8.81 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.666 0.617 . . . . 10.0 112.666 171.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.441 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -87.36 -71.29 0.57 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 122.946 0.498 . . . . 10.0 112.018 -177.356 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.3 t -160.13 36.49 0.17 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.495 0.718 . . . . 10.0 112.312 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.5 ptmm? 33.23 66.55 0.21 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 126.349 1.859 . . . . 10.0 114.796 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.548 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -163.17 -49.18 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.141 -0.936 . . . . 10.0 113.356 -178.209 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.4 ' HE3' ' CG ' ' A' ' 23' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.72 0 CA-C-O 118.089 -0.958 . . . . 10.0 111.511 179.279 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.539 0.526 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -151.87 121.07 6.73 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.191 0.996 . . . . 10.0 109.782 -174.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -42.83 -44.39 4.45 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.132 1.373 . . . . 10.0 113.693 170.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -55.96 -50.99 69.25 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.94 0.4 . . . . 10.0 110.312 175.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.33 -31.83 70.54 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.775 -0.578 . . . . 10.0 111.27 -176.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mt -67.59 -51.94 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.24 -41.68 76.64 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 119.077 -1.049 . . . . 10.0 111.025 178.352 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -67.15 -21.42 65.82 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.315 1.446 . . . . 10.0 112.161 -177.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.41 -27.53 18.26 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.445 1.276 . . . . 10.0 114.445 166.801 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.69 -70.7 0.8 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.796 1.238 . . . . 10.0 111.582 -168.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.98 38.69 0.17 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.115 1.766 . . . . 10.0 110.224 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.9 t -119.26 -6.13 10.38 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 125.301 1.44 . . . . 10.0 113.833 -167.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.7 t -93.86 -38.06 9.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-O 122.322 1.058 . . . . 10.0 108.304 -175.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.6 m -110.83 -60.18 1.86 Allowed 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 126.474 1.909 . . . . 10.0 109.507 -167.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -74.49 -26.12 59.81 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 114.061 1.134 . . . . 10.0 114.061 -170.928 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 t -58.55 -55.0 40.72 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.966 0.906 . . . . 10.0 110.916 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.8 mmt -101.07 -23.87 14.41 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.645 1.178 . . . . 10.0 112.06 -178.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.64 52.93 2.7 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 124.92 1.248 . . . . 10.0 112.08 -174.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.7 t -93.25 156.17 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 125.389 1.475 . . . . 10.0 109.525 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.78 25.05 11.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.263 1.025 . . . . 10.0 113.106 -176.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.06 12.05 83.62 Favored Glycine 0 CA--C 1.535 1.306 0 C-N-CA 123.83 0.729 . . . . 10.0 113.206 -175.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.14 152.31 72.2 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 118.289 1.044 . . . . 10.0 111.995 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.26 169.51 21.85 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.739 2.959 . . . . 10.0 110.538 -177.356 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -78.07 146.68 35.11 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.634 -0.666 . . . . 10.0 112.382 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.17 -30.32 6.66 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.093 1.357 . . . . 10.0 113.976 168.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.6 p80 -146.44 114.92 6.75 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.045 -1.034 . . . . 10.0 110.006 174.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.412 HD22 ' CG ' ' A' ' 30' ' ' ASP . 5.3 m-20 -144.54 168.47 20.08 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.782 -1.192 . . . . 10.0 107.782 174.297 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 97.5 m -109.61 -32.38 7.13 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 119.294 -0.384 . . . . 10.0 110.955 167.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.57 -28.4 45.88 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 114.6 1.333 . . . . 10.0 114.6 -175.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.412 ' CG ' HD22 ' A' ' 27' ' ' ASN . 0.7 OUTLIER -81.15 -33.45 33.14 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.908 0.861 . . . . 10.0 109.498 176.061 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.452 ' CE3' ' HB2' ' A' ' 75' ' ' SER . 62.7 m95 -77.7 -41.08 39.21 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.155 0.982 . . . . 10.0 109.997 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -39.92 -65.04 0.46 Allowed Pre-proline 0 CA--C 1.549 0.907 0 CA-C-N 120.627 1.558 . . . . 10.0 114.9 174.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -70.9 -0.65 8.19 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 123.512 2.808 . . . . 10.0 113.495 -178.329 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.72 -34.67 9.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.311 1.444 . . . . 10.0 109.905 170.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 tp -98.53 20.68 12.38 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 128.228 2.611 . . . . 10.0 111.998 -173.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -106.89 16.29 24.48 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.638 1.575 . . . . 10.0 110.346 174.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -133.2 -45.3 0.84 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 126.434 1.894 . . . . 10.0 110.504 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 163.46 -142.59 7.96 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 109.343 -1.503 . . . . 10.0 109.343 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.1 t -129.75 -55.01 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 123.783 0.833 . . . . 10.0 109.737 -177.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.64 32.93 0.08 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.216 1.806 . . . . 10.0 113.294 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -106.06 -46.56 4.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 128.151 2.58 . . . . 10.0 108.044 176.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 42' ' ' LEU . 1.4 mm? -83.17 -40.22 19.99 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.016 0.927 . . . . 10.0 111.51 -173.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 p -55.9 -26.6 21.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-O 121.612 0.72 . . . . 10.0 110.523 171.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.3 mmtt -72.6 -37.35 68.15 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.333 -0.854 . . . . 10.0 112.561 173.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.7 m -67.25 -32.98 74.37 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.973 0.892 . . . . 10.0 110.573 174.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.5 t -57.84 -49.33 81.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 O-C-N 121.443 -0.785 . . . . 10.0 111.858 171.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -28.45 69.66 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.062 0.764 . . . . 10.0 113.062 -177.667 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.0 p -83.59 -29.62 27.62 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.941 0.719 . . . . 10.0 112.941 174.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.0 101.22 0.33 Allowed Glycine 0 CA--C 1.527 0.818 0 CA-C-N 118.663 0.665 . . . . 10.0 112.445 -171.229 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.27 173.94 1.36 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.437 0.637 . . . . 10.0 111.141 165.22 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -47.69 -57.88 4.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.439 1.496 . . . . 10.0 114.136 -167.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -99.26 23.48 9.15 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.359 1.464 . . . . 10.0 111.264 177.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -112.55 154.99 44.48 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 114.735 1.383 . . . . 10.0 114.735 172.053 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -76.06 134.44 16.1 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 122.782 2.321 . . . . 10.0 110.539 175.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -66.56 117.27 4.6 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.124 2.549 . . . . 10.0 110.288 178.224 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.76 30.91 10.7 Favored Glycine 0 C--N 1.343 0.926 0 C-N-CA 120.102 -1.047 . . . . 10.0 110.546 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.18 38.5 6.41 Favored Glycine 0 CA--C 1.531 1.054 0 CA-C-N 117.728 0.764 . . . . 10.0 114.482 178.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 73.48 -59.51 0.56 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.163 1.385 . . . . 10.0 111.367 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.4 t -82.76 98.31 9.03 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 125.151 1.38 . . . . 10.0 110.798 170.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.1 t -59.91 -42.11 93.16 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.422 169.36 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -79.41 57.22 2.32 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.036 1.334 . . . . 10.0 111.189 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.9 m -127.97 134.43 49.28 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 126.105 1.762 . . . . 10.0 110.975 -175.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 m -103.75 141.7 35.64 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.772 0.829 . . . . 10.0 109.942 -178.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -44.32 -34.95 2.13 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.028 1.121 . . . . 10.0 114.028 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -45.42 -56.65 4.78 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.502 1.121 . . . . 10.0 110.807 169.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.89 -44.59 26.64 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.434 1.494 . . . . 10.0 108.8 -175.075 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -47.43 85.65 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.012 1.325 . . . . 10.0 110.542 -174.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.0 mtpm? -69.48 -44.46 71.11 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.526 -0.733 . . . . 10.0 111.144 174.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.59 -27.41 6.75 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 119.288 0.949 . . . . 10.0 112.905 170.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.11 -46.48 11.9 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.139 -0.976 . . . . 10.0 110.656 173.521 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.2 tp -53.42 -34.94 23.86 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.695 1.198 . . . . 10.0 113.214 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.44 -17.95 29.34 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.288 1.435 . . . . 10.0 113.214 177.37 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -53.05 -44.99 67.85 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.402 -0.811 . . . . 10.0 111.941 174.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.3 mpp? -71.62 -62.19 1.5 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.479 1.112 . . . . 10.0 112.362 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.452 ' HB2' ' CE3' ' A' ' 31' ' ' TRP . 15.4 m -141.66 -93.84 0.14 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.215 1.006 . . . . 10.0 110.056 172.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.8 ptmt -174.89 56.11 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.984 1.313 . . . . 10.0 109.022 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.71 -75.38 0.05 Allowed 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 114.26 1.207 . . . . 10.0 114.26 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.41 ' HG3' ' CE3' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.186 0 N-CA-C 115.761 1.763 . . . . 10.0 115.761 -160.376 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 112.47 0.544 . . . . 10.0 112.47 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -147.22 122.75 10.42 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.433 0.635 . . . . 10.0 109.459 -176.407 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -45.25 -40.77 7.81 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.794 1.238 . . . . 10.0 113.522 167.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -54.87 -50.82 67.76 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-N 118.117 0.417 . . . . 10.0 110.617 172.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.38 -31.52 70.95 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 122.022 -0.424 . . . . 10.0 110.647 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.75 -51.99 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 108.633 -0.877 . . . . 10.0 108.633 177.234 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.429 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.74 -41.95 74.59 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 118.951 -1.1 . . . . 10.0 111.251 -177.954 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -68.17 -22.05 64.86 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.809 1.644 . . . . 10.0 112.16 -177.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.42 -29.07 16.47 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.932 1.086 . . . . 10.0 113.932 166.535 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -106.05 -67.27 0.94 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.263 1.025 . . . . 10.0 112.933 -170.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.429 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.73 43.05 0.39 Allowed 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.883 1.273 . . . . 10.0 109.374 -179.1 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 t -126.79 -5.0 6.37 Favored 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 125.333 1.453 . . . . 10.0 113.501 -165.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 41.2 t -99.02 -51.63 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 124.985 1.314 . . . . 10.0 108.083 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 80.4 m -92.01 -59.01 2.21 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.426 1.891 . . . . 10.0 109.906 -174.091 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 -73.97 -16.92 61.06 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.033 1.123 . . . . 10.0 114.033 -171.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.7 t -65.34 -50.01 67.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.766 -0.584 . . . . 10.0 111.24 -178.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 tpt -106.96 -26.27 11.26 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.291 1.036 . . . . 10.0 112.256 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.78 55.22 1.33 Allowed Glycine 0 CA--C 1.535 1.343 0 C-N-CA 125.211 1.386 . . . . 10.0 111.9 -174.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 90.8 t -95.6 156.46 3.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 125.291 1.437 . . . . 10.0 109.69 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.12 25.95 11.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.218 1.007 . . . . 10.0 112.802 -174.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.74 7.44 88.21 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.105 0.86 . . . . 10.0 113.508 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.43 147.03 92.73 Favored Pre-proline 0 CA--C 1.55 0.977 0 CA-C-N 118.807 1.304 . . . . 10.0 112.35 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -67.12 172.23 10.22 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 125.099 3.866 . . . . 10.0 110.29 172.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -124.26 135.33 53.33 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.763 0.825 . . . . 10.0 111.52 -176.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 p -78.79 52.89 1.28 Allowed 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.825 -1.172 . . . . 10.0 113.166 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -146.54 -43.3 0.19 Allowed 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.885 1.439 . . . . 10.0 114.885 178.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.67 146.13 32.62 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.932 1.293 . . . . 10.0 108.877 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 38.2 m -94.44 -29.0 15.19 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.253 0.933 . . . . 10.0 110.155 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.46 -29.85 68.1 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.689 0.996 . . . . 10.0 113.689 177.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.458 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 60.7 t0 -71.32 -34.03 70.2 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.434 1.094 . . . . 10.0 109.26 174.384 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.434 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 49.0 m95 -90.03 -31.27 17.26 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 125.094 1.358 . . . . 10.0 113.254 -175.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -47.01 -56.59 11.48 Favored Pre-proline 0 CA--C 1.541 0.613 0 O-C-N 120.493 -1.379 . . . . 10.0 114.603 174.77 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.43 -0.02 4.59 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 122.579 2.186 . . . . 10.0 113.278 -178.475 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -93.6 -49.19 6.0 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.499 -0.751 . . . . 10.0 109.567 170.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.36 22.8 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.533 1.308 . . . . 10.0 114.533 170.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -93.94 -37.76 11.53 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.396 1.078 . . . . 10.0 109.698 176.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt -85.83 -46.01 11.04 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.948 0.899 . . . . 10.0 111.151 175.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 152.81 -143.58 10.46 Favored Glycine 0 CA--C 1.534 1.248 0 N-CA-C 110.353 -1.099 . . . . 10.0 110.353 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.8 t -123.76 -54.53 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.194 0.998 . . . . 10.0 110.901 -174.212 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.95 -13.85 7.6 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.443 1.497 . . . . 10.0 113.207 -178.343 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.84 -16.04 61.61 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 126.093 1.757 . . . . 10.0 113.47 175.993 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 mp -103.9 -43.99 5.16 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.228 0.611 . . . . 10.0 110.379 -171.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.3 p -53.8 -34.15 24.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.05 0.54 . . . . 10.0 111.103 170.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.6 ptmt -63.51 -43.96 95.68 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.823 -1.173 . . . . 10.0 113.91 170.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.5 m -66.55 -32.72 74.24 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 120.631 -1.293 . . . . 10.0 110.034 -178.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 40.5 t -60.43 -54.89 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 123.563 0.745 . . . . 10.0 111.099 172.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.62 -31.9 69.92 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.903 0.705 . . . . 10.0 112.903 178.451 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.8 m -71.1 -27.48 63.62 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.442 0.697 . . . . 10.0 112.471 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 74.31 90.68 0.17 Allowed Glycine 0 CA--C 1.529 0.969 0 CA-C-N 119.196 0.907 . . . . 10.0 112.539 -175.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.41 168.51 2.71 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.961 0.886 . . . . 10.0 111.634 173.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -52.98 -57.96 8.58 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 120.468 -1.395 . . . . 10.0 112.85 -169.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.6 17.94 3.04 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.189 1.396 . . . . 10.0 112.722 173.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ttp -131.66 130.26 22.31 Favored Pre-proline 0 CA--C 1.545 0.763 0 N-CA-C 115.021 1.489 . . . . 10.0 115.021 -175.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.08 143.04 76.98 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 121.452 1.434 . . . . 10.0 112.309 -178.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -61.92 133.06 42.53 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 123.679 2.919 . . . . 10.0 109.946 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.79 11.75 85.13 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 119.579 -1.296 . . . . 10.0 112.735 -173.141 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 56.81 53.94 40.32 Favored Glycine 0 CA--C 1.532 1.138 0 O-C-N 120.74 -1.447 . . . . 10.0 110.88 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 80.12 -45.52 0.29 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.835 2.054 . . . . 10.0 112.603 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.08 162.39 25.89 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.642 0.777 . . . . 10.0 111.583 175.019 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.7 m -114.42 -57.41 2.28 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.315 1.046 . . . . 10.0 110.504 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -82.48 68.03 8.76 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 122.418 1.104 . . . . 10.0 109.871 -178.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.76 116.79 32.34 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.837 1.655 . . . . 10.0 110.432 -177.332 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -84.48 130.63 34.74 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 126.557 1.943 . . . . 10.0 109.334 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -45.58 -35.72 4.19 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.898 0.879 . . . . 10.0 113.261 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -50.17 -59.76 3.62 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.187 0.995 . . . . 10.0 113.162 167.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -74.62 -26.47 59.92 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 120.961 -1.087 . . . . 10.0 109.907 -177.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -55.82 14.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.909 1.284 . . . . 10.0 110.959 177.316 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.55 -44.49 96.93 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 177.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.75 -24.96 38.34 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.412 0.523 . . . . 10.0 112.412 173.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -85.61 -48.0 9.3 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.534 -0.729 . . . . 10.0 109.86 176.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.2 tp -57.42 -30.33 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.705 1.602 . . . . 10.0 112.747 178.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.63 -28.56 23.14 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.205 1.002 . . . . 10.0 113.549 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -51.87 -51.35 57.33 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.431 1.014 . . . . 10.0 112.139 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.434 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.3 mpp? -64.96 -36.87 85.78 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.718 0.636 . . . . 10.0 112.718 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -166.8 -74.18 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.465 0.706 . . . . 10.0 110.934 172.12 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 164.1 43.58 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 128.281 2.632 . . . . 10.0 110.842 -170.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.63 -81.58 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 115.418 1.636 . . . . 10.0 115.418 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.458 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 3.0 ptpt . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.282 -1.342 . . . . 10.0 113.925 -176.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.535 0.372 0 CA-C-O 120.064 -0.017 . . . . 10.0 111.013 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 58.5 t0 -149.52 119.82 7.32 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.198 0.999 . . . . 10.0 110.007 173.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -44.52 -42.34 7.12 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.004 1.321 . . . . 10.0 113.93 167.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -57.94 -46.58 84.83 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 122.208 -0.307 . . . . 10.0 110.428 173.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.41 -34.18 76.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.963 -0.461 . . . . 10.0 110.701 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.5 mm -64.86 -51.25 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 O-C-N 121.575 -0.703 . . . . 10.0 109.143 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.414 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.1 -42.01 76.68 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 117.791 -1.563 . . . . 10.0 111.988 179.514 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.61 -22.0 64.47 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.513 1.525 . . . . 10.0 112.579 -176.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -92.64 -29.21 16.24 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.548 1.139 . . . . 10.0 113.249 170.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.18 -64.49 1.29 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.143 0.977 . . . . 10.0 112.995 -170.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.414 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.04 37.81 0.16 Allowed 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.811 1.244 . . . . 10.0 110.887 178.184 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -120.57 -1.35 10.1 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 125.024 1.329 . . . . 10.0 113.316 -165.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.2 t -105.66 -46.57 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 124.647 1.179 . . . . 10.0 108.874 -171.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.9 m -87.82 -64.52 1.14 Allowed 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 125.703 1.601 . . . . 10.0 111.571 174.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -72.57 -25.57 61.4 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.565 0.746 . . . . 10.0 112.993 -162.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.8 t -55.01 -50.31 69.36 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.874 1.269 . . . . 10.0 111.094 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.5 tpt -106.08 -21.29 13.17 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.945 0.898 . . . . 10.0 112.635 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.56 45.27 3.76 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.138 0.875 . . . . 10.0 112.353 -176.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 57.7 t -86.06 160.18 3.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 124.568 1.147 . . . . 10.0 109.384 177.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.97 17.16 5.15 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.806 1.243 . . . . 10.0 113.531 -175.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.84 18.38 78.91 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.128 0.87 . . . . 10.0 113.417 -173.416 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.0 143.55 98.02 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-N 118.507 1.154 . . . . 10.0 112.831 -177.112 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -66.96 147.47 80.31 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.142 3.228 . . . . 10.0 110.118 177.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -69.1 139.49 54.77 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.792 -167.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 72.4 m -37.96 -35.3 0.15 Allowed 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.48 1.512 . . . . 10.0 114.512 173.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -141.94 108.75 5.4 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.737 1.615 . . . . 10.0 107.862 174.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -135.28 167.28 21.31 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.757 1.623 . . . . 10.0 106.737 171.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 88.2 m -110.84 -35.77 5.87 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.385 0.539 . . . . 10.0 112.123 171.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.05 -17.19 44.13 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 121.119 -0.988 . . . . 10.0 113.072 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -85.23 -29.77 24.39 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.272 1.829 . . . . 10.0 110.114 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.462 ' CZ3' ' HB2' ' A' ' 74' ' ' MET . 50.4 m95 -92.61 -38.34 11.94 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.869 2.068 . . . . 10.0 111.204 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -41.78 -60.52 1.89 Allowed Pre-proline 0 CA--C 1.552 1.038 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 173.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -64.24 -4.79 8.43 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.561 2.841 . . . . 10.0 114.053 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -98.25 -53.02 3.48 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.748 1.619 . . . . 10.0 108.308 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.475 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 1.4 mt -58.9 -19.39 41.79 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.566 1.547 . . . . 10.0 113.338 174.019 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.16 -30.58 55.07 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.143 1.377 . . . . 10.0 109.488 -177.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -82.57 -52.2 7.05 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.854 -0.424 . . . . 10.0 109.854 174.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 167.99 -125.26 1.28 Allowed Glycine 0 CA--C 1.532 1.106 0 N-CA-C 111.339 -0.704 . . . . 10.0 111.339 177.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.7 t -141.61 -59.71 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-O 122.105 0.955 . . . . 10.0 109.461 -178.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -71.69 17.35 0.09 Allowed 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 124.277 1.031 . . . . 10.0 112.652 -173.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.43 -18.36 18.29 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 128.249 2.62 . . . . 10.0 110.39 177.366 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -101.51 -41.92 6.44 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.999 0.92 . . . . 10.0 111.053 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.3 p -49.62 -35.38 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-O 121.477 0.656 . . . . 10.0 111.264 170.258 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 ptmt -63.66 -44.39 93.91 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 114.707 1.373 . . . . 10.0 114.707 172.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.14 -23.61 63.03 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 119.156 0.889 . . . . 10.0 110.91 178.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.0 t -67.33 -53.92 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 O-C-N 121.584 -0.697 . . . . 10.0 111.703 168.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.51 -34.82 74.65 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.949 -0.469 . . . . 10.0 112.035 177.994 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.64 -31.32 61.92 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.39 0.676 . . . . 10.0 112.169 177.656 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.0 105.5 0.15 Allowed Glycine 0 C--N 1.341 0.808 0 N-CA-C 111.485 -0.646 . . . . 10.0 111.485 -166.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.5 tp -63.14 172.01 2.04 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.877 -0.778 . . . . 10.0 110.247 167.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -49.02 -58.27 5.18 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.742 1.217 . . . . 10.0 113.488 -169.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -86.09 18.97 2.81 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.018 1.327 . . . . 10.0 112.923 174.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 5.9 mtp -119.24 147.28 42.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 N-CA-C 114.269 1.211 . . . . 10.0 114.269 173.378 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.29 141.44 32.13 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.137 1.891 . . . . 10.0 110.425 172.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -61.6 124.36 14.48 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.003 2.469 . . . . 10.0 109.884 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.67 17.03 57.52 Favored Glycine 0 C--N 1.34 0.776 0 C-N-CA 119.994 -1.098 . . . . 10.0 111.824 -178.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 52.93 36.3 50.51 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 118.875 1.337 . . . . 10.0 113.511 172.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 66.54 21.99 10.65 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.323 1.849 . . . . 10.0 114.102 -175.316 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.9 t -122.74 166.61 14.65 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.287 1.835 . . . . 10.0 110.577 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.8 t -115.47 -55.59 2.43 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.393 1.077 . . . . 10.0 111.551 177.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -115.43 49.97 1.04 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.714 1.206 . . . . 10.0 110.99 -177.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.9 m -80.09 117.54 20.99 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 120.394 -1.441 . . . . 10.0 110.624 174.74 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 34.7 p -79.7 139.0 37.51 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -45.51 -32.22 2.14 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.757 0.823 . . . . 10.0 113.202 176.765 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -52.61 -61.8 2.05 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 119.257 0.935 . . . . 10.0 112.535 169.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -27.77 62.39 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.551 -0.718 . . . . 10.0 110.495 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -50.02 45.45 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.46 1.124 . . . . 10.0 109.972 -177.521 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -64.85 -51.65 60.88 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 124.58 1.152 . . . . 10.0 109.021 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.43 -35.07 12.07 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 118.871 0.759 . . . . 10.0 112.523 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.27 -34.04 61.31 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 120.946 -1.096 . . . . 10.0 112.213 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.65 -51.57 27.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.048 1.739 . . . . 10.0 110.7 175.383 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.6 -28.32 69.84 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.033 1.333 . . . . 10.0 112.881 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -42.16 -41.34 2.64 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.884 0.698 . . . . 10.0 112.884 170.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.462 ' HB2' ' CZ3' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -77.59 -69.77 0.52 Allowed 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 111.998 0.369 . . . . 10.0 111.998 179.854 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.8 t -163.08 32.23 0.09 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.685 0.995 . . . . 10.0 113.685 -176.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 37.29 53.95 1.3 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.443 1.897 . . . . 10.0 115.047 177.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.475 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -140.77 -54.64 0.5 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.923 0.889 . . . . 10.0 112.836 -177.054 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.408 ' HG3' ' CE3' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.898 0 CA-C-O 116.666 -1.635 . . . . 10.0 110.559 171.184 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.522 0 N-CA-C 114.281 1.215 . . . . 10.0 114.281 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -136.93 -168.09 2.21 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 106.218 -1.771 . . . . 10.0 106.218 -177.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -103.34 -41.75 5.93 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 127.522 2.329 . . . . 10.0 111.998 176.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -54.85 -51.5 65.7 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 122.195 0.997 . . . . 10.0 109.772 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.96 -30.08 69.28 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.144 -0.935 . . . . 10.0 110.858 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.56 -52.0 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.68 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.404 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.5 OUTLIER -69.71 -40.08 76.49 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.758 0.708 . . . . 10.0 110.39 -176.769 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -68.94 -23.95 64.21 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.391 1.077 . . . . 10.0 112.035 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.41 -30.66 19.32 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.612 1.338 . . . . 10.0 114.612 166.335 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.65 -69.54 0.86 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.959 1.304 . . . . 10.0 111.637 -167.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.404 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.38 43.95 0.25 Allowed 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 125.516 1.526 . . . . 10.0 110.345 178.612 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.9 t -127.1 -7.13 5.98 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.701 1.601 . . . . 10.0 113.668 -167.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 48.4 t -94.17 -42.72 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 N-CA-C 108.243 -1.021 . . . . 10.0 108.243 -175.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.9 m -104.97 -57.2 2.06 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.737 1.615 . . . . 10.0 109.358 -173.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -74.13 -14.77 61.02 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 114.825 1.417 . . . . 10.0 114.825 -171.053 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.6 t -70.24 -43.99 69.44 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.434 0.693 . . . . 10.0 110.408 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 25.5 mmt -114.64 -40.42 3.58 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.271 1.428 . . . . 10.0 112.247 -175.422 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.21 61.67 1.13 Allowed Glycine 0 CA--C 1.535 1.322 0 C-N-CA 125.737 1.637 . . . . 10.0 112.682 -178.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 94.0 t -82.65 -56.53 5.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 121.631 0.729 . . . . 10.0 111.991 -175.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.97 30.79 0.44 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.909 0.884 . . . . 10.0 111.211 177.058 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 65.83 18.41 66.32 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 124.026 0.822 . . . . 10.0 113.195 -172.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.23 142.88 97.79 Favored Pre-proline 0 CA--C 1.539 0.536 0 O-C-N 121.681 -0.894 . . . . 10.0 111.676 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -75.27 149.38 35.55 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 122.841 2.361 . . . . 10.0 111.182 -172.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -63.58 134.5 55.6 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.041 -0.527 . . . . 10.0 112.34 -175.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.1 p -48.08 -22.96 0.7 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.079 1.752 . . . . 10.0 114.453 173.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.76 40.14 1.84 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.135 0.879 . . . . 10.0 113.125 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -77.09 151.36 35.48 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.524 -0.735 . . . . 10.0 110.607 169.684 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.3 m -107.51 -30.57 8.56 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.704 0.402 . . . . 10.0 110.978 165.019 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.63 -36.58 70.78 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.945 -1.097 . . . . 10.0 113.179 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -79.23 -30.18 43.09 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.91 0.862 . . . . 10.0 110.281 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.9 m95 -82.48 -31.56 29.28 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.967 1.707 . . . . 10.0 111.751 178.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -40.7 -62.04 1.08 Allowed Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.07 1.348 . . . . 10.0 113.954 172.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.17 6.66 2.08 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.851 2.367 . . . . 10.0 113.787 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.482 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 29.2 mmt180 -108.49 -42.63 4.51 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.18 1.392 . . . . 10.0 109.345 177.457 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.05 6.12 2.32 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.081 1.752 . . . . 10.0 112.823 176.303 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.19 -34.96 37.01 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.53 1.532 . . . . 10.0 109.205 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -80.92 -61.01 2.09 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.3 170.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 150.17 -127.94 2.54 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.428 -0.669 . . . . 10.0 111.428 175.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.9 m -122.42 172.77 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 126.331 1.852 . . . . 10.0 109.172 175.198 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 63.15 9.5 3.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.838 1.255 . . . . 10.0 113.832 -176.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -92.63 -62.14 1.45 Allowed 'General case' 0 C--N 1.343 0.295 0 CA-C-O 122.419 1.104 . . . . 10.0 108.913 170.129 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.66 -26.66 60.01 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.734 0.814 . . . . 10.0 111.468 -172.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.01 -29.43 46.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 O-C-N 121.611 -0.681 . . . . 10.0 110.371 173.315 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -69.28 -43.0 74.76 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.538 -0.727 . . . . 10.0 110.976 176.109 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -39.09 93.08 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.507 -0.746 . . . . 10.0 109.939 176.196 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.431 HG12 ' CZ ' ' A' ' 67' ' ' TYR . 2.4 t -56.12 -48.55 78.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.407 0.623 . . . . 10.0 111.85 178.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.97 -32.01 72.97 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.896 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 54.6 m -74.47 -29.66 61.54 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.083 0.953 . . . . 10.0 113.547 175.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.29 117.98 0.35 Allowed Glycine 0 CA--C 1.529 0.962 0 CA-C-N 119.306 0.957 . . . . 10.0 111.496 -170.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.6 tp -72.56 -145.3 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.162 0.985 . . . . 10.0 110.628 168.03 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -80.64 -67.24 0.79 Allowed 'General case' 0 N--CA 1.477 0.893 0 O-C-N 119.648 -1.907 . . . . 10.0 111.301 -174.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.2 -14.74 60.14 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.276 1.43 . . . . 10.0 111.381 176.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 ttp -97.67 120.44 60.48 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 123.726 0.81 . . . . 10.0 110.862 -175.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -70.74 157.22 59.11 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 121.718 1.612 . . . . 10.0 111.31 -175.456 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -62.49 116.88 3.8 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 123.031 2.488 . . . . 10.0 110.23 -179.166 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 98.49 35.91 4.78 Favored Glycine 0 C--N 1.344 1.018 0 CA-C-N 118.058 0.39 . . . . 10.0 113.104 -176.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 53.39 -86.66 0.01 OUTLIER Glycine 0 CA--C 1.537 1.425 0 C-N-CA 124.533 1.063 . . . . 10.0 113.998 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.6 ttt -171.98 40.16 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 127.242 2.217 . . . . 10.0 110.226 172.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.8 p -131.29 170.76 14.17 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.56 1.319 . . . . 10.0 114.56 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 55.3 m -81.99 -98.77 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.928 1.291 . . . . 10.0 109.966 175.82 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -82.35 64.29 6.94 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.957 -1.089 . . . . 10.0 109.434 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 4.2 m -60.75 86.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.807 0 CA-C-O 121.301 0.572 . . . . 10.0 111.495 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.3 p -78.23 132.27 37.48 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 120.776 -1.203 . . . . 10.0 108.186 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -46.77 -32.04 3.4 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.966 0.906 . . . . 10.0 112.515 178.049 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -52.72 -59.48 4.43 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.327 1.451 . . . . 10.0 113.968 166.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -73.89 -36.07 64.75 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 107.932 -1.136 . . . . 10.0 107.932 -175.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.431 ' CZ ' HG12 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -55.92 -60.24 3.75 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 123.165 0.586 . . . . 10.0 111.064 172.618 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.8 ptmt -57.82 -48.32 80.09 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.338 1.055 . . . . 10.0 109.873 -177.026 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.94 -22.25 14.42 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.758 0.651 . . . . 10.0 112.758 172.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -101.79 -9.82 20.46 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 124.701 1.2 . . . . 10.0 113.859 -174.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.412 HG22 ' O ' ' A' ' 67' ' ' TYR . 0.0 OUTLIER -99.94 -38.76 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.962 0.905 . . . . 10.0 109.809 167.36 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -37.93 77.36 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.322 0.649 . . . . 10.0 111.698 175.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -49.93 -38.56 36.85 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.015 0.926 . . . . 10.0 112.462 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -79.35 -65.17 1.03 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.625 0.37 . . . . 10.0 111.991 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 t -164.3 27.94 0.07 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 119.451 -0.9 . . . . 10.0 112.917 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt 40.0 46.81 1.84 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.784 0.834 . . . . 10.0 113.134 -175.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.482 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -132.64 -84.66 0.47 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.887 1.275 . . . . 10.0 113.435 173.157 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.277 0 N-CA-C 115.651 1.722 . . . . 10.0 115.651 -164.415 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 8.4 mp0 . . . . . 0 CA--C 1.528 0.129 0 N-CA-C 112.144 0.424 . . . . 10.0 112.144 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -141.62 123.38 15.22 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 108.636 -0.876 . . . . 10.0 108.636 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -54.1 -36.1 62.84 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 124.134 0.974 . . . . 10.0 112.679 172.333 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -59.04 -47.41 85.34 Favored 'General case' 0 C--N 1.34 0.17 0 N-CA-C 110.426 -0.212 . . . . 10.0 110.426 170.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.78 -34.33 76.58 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.743 -0.598 . . . . 10.0 110.621 -178.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.402 ' CD1' ' HB3' ' A' ' 66' ' ' ASP . 33.8 mt -64.37 -51.61 66.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 N-CA-C 108.428 -0.952 . . . . 10.0 108.428 178.243 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.492 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -69.29 -42.3 75.66 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 117.695 -1.602 . . . . 10.0 112.294 -179.757 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -68.86 -22.48 64.2 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.641 1.576 . . . . 10.0 112.752 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -94.78 -28.8 15.09 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.95 0.722 . . . . 10.0 112.95 170.335 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -108.11 -64.94 1.16 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.052 0.941 . . . . 10.0 112.562 -171.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.42 44.16 0.34 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.742 1.217 . . . . 10.0 110.483 179.278 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.5 t -129.8 -6.32 4.55 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 124.883 1.273 . . . . 10.0 113.794 -164.239 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.6 t -97.11 -46.74 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 124.779 1.231 . . . . 10.0 108.236 -176.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 82.3 m -92.07 -63.68 1.21 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 127.582 2.353 . . . . 10.0 110.507 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -73.61 -20.92 60.46 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.961 1.097 . . . . 10.0 113.961 -167.448 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.8 t -57.82 -53.59 56.46 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.505 1.122 . . . . 10.0 111.394 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.0 tpt -108.91 -12.78 14.84 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.768 0.827 . . . . 10.0 112.422 -178.101 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.42 40.84 7.64 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.266 0.936 . . . . 10.0 112.264 -175.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 68.8 t -80.08 155.91 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.469 1.108 . . . . 10.0 109.149 176.692 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 55.6 21.63 4.65 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.772 1.229 . . . . 10.0 113.619 -176.322 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.87 20.52 76.02 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 124.231 0.919 . . . . 10.0 113.842 -176.473 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.83 141.77 79.22 Favored Pre-proline 0 CA--C 1.547 0.856 0 CA-C-N 118.64 1.22 . . . . 10.0 113.681 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.31 132.7 13.97 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 124.763 3.642 . . . . 10.0 111.815 -176.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -61.49 142.77 56.8 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.705 -1.247 . . . . 10.0 113.835 -161.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.0 m -50.83 -33.59 24.27 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.347 0.869 . . . . 10.0 113.347 176.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -125.63 117.61 23.9 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.248 1.019 . . . . 10.0 108.698 167.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -151.8 163.55 38.94 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.278 1.831 . . . . 10.0 106.838 172.242 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 96.5 m -110.08 -36.6 5.81 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.45 0.568 . . . . 10.0 111.138 170.267 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.95 -19.61 34.34 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.501 -0.749 . . . . 10.0 113.02 -175.562 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -83.09 -34.08 26.22 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.279 1.432 . . . . 10.0 110.283 178.175 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.431 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 63.7 m95 -82.24 -40.73 21.2 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.233 1.813 . . . . 10.0 111.624 176.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -39.49 -60.11 1.39 Allowed Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 114.496 1.295 . . . . 10.0 114.496 175.099 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -65.04 -8.3 17.87 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.389 2.726 . . . . 10.0 114.151 -177.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -95.77 -53.48 3.69 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.845 0.858 . . . . 10.0 110.152 170.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.47 -18.88 4.76 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.641 1.577 . . . . 10.0 113.394 178.073 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.63 -32.81 36.14 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.637 1.575 . . . . 10.0 109.993 -176.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.54 -46.65 12.18 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.876 -0.787 . . . . 10.0 108.876 174.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 163.88 -142.82 8.09 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 110.892 -0.883 . . . . 10.0 110.892 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.4 t -134.63 -56.27 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 122.707 1.241 . . . . 10.0 109.673 -174.443 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.67 -29.86 28.76 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 127.167 2.187 . . . . 10.0 111.232 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.547 ' ND2' ' H ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -55.92 -20.12 14.8 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.421 1.888 . . . . 10.0 113.916 175.3 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -103.13 -43.53 5.45 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.844 0.858 . . . . 10.0 111.061 -175.184 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 p -53.69 -34.07 23.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 118.119 0.418 . . . . 10.0 111.185 171.006 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -59.29 -48.55 81.21 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.099 1.148 . . . . 10.0 114.099 167.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.9 m -62.86 -35.14 79.0 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 120.617 -1.302 . . . . 10.0 110.152 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 28.5 t -58.04 -54.18 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.055 173.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.5 ptmt -61.83 -33.74 74.7 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.573 0.582 . . . . 10.0 112.573 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 97.6 m -72.01 -33.54 68.14 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.48 0.712 . . . . 10.0 112.37 -178.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.54 98.34 0.42 Allowed Glycine 0 CA--C 1.531 1.08 0 CA-C-N 118.809 0.731 . . . . 10.0 111.929 -173.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 5.0 tp -67.48 170.13 8.01 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.279 1.031 . . . . 10.0 111.106 174.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -52.68 -57.65 9.38 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.736 -1.228 . . . . 10.0 112.365 -171.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.32 20.9 9.74 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.33 1.452 . . . . 10.0 112.383 172.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 40.3 ttp -125.6 125.34 25.01 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 114.001 1.112 . . . . 10.0 114.001 172.153 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -61.87 151.22 82.44 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.868 1.712 . . . . 10.0 111.925 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -61.57 140.15 85.36 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 123.171 2.58 . . . . 10.0 110.677 -177.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.75 30.76 73.43 Favored Glycine 0 CA--C 1.53 1.008 0 CA-C-N 116.502 -0.317 . . . . 10.0 112.734 -170.689 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.51 36.27 5.93 Favored Glycine 0 CA--C 1.536 1.396 0 O-C-N 121.693 -0.886 . . . . 10.0 114.314 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.2 ttt 84.93 12.41 0.26 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.936 2.094 . . . . 10.0 114.685 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.7 m -106.35 167.52 9.78 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.594 1.158 . . . . 10.0 112.338 171.248 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.1 m -131.19 -49.48 1.01 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.882 1.673 . . . . 10.0 110.167 171.486 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -79.43 -29.77 42.02 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.414 1.486 . . . . 10.0 112.693 -175.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 21.9 m -55.21 122.29 10.73 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.108 1.763 . . . . 10.0 111.197 179.25 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.0 m -103.0 162.22 13.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.55 1.94 . . . . 10.0 109.539 -176.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -44.98 -44.77 10.14 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.788 -1.195 . . . . 10.0 113.627 176.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -50.0 -40.11 43.34 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.838 0.855 . . . . 10.0 112.248 174.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.402 ' HB3' ' CD1' ' A' ' 6' ' ' ILE . 0.4 OUTLIER -84.46 -44.08 14.0 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.619 0.767 . . . . 10.0 111.154 178.239 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -58.03 -50.2 74.23 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.895 -1.128 . . . . 10.0 112.285 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -58.41 -46.52 86.29 Favored 'General case' 0 N--CA 1.463 0.216 0 O-C-N 121.783 -0.573 . . . . 10.0 110.027 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.5 -34.34 64.52 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 121.923 0.868 . . . . 10.0 112.858 170.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.34 -41.28 63.65 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 120.222 -1.549 . . . . 10.0 111.456 -178.078 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.2 pt -75.69 -33.13 25.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 O-C-N 121.646 -0.659 . . . . 10.0 112.634 175.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -69.86 -32.69 71.2 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.566 -0.709 . . . . 10.0 111.206 174.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -48.51 -48.34 38.22 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 119.092 0.86 . . . . 10.0 111.167 172.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.413 ' HB3' ' CZ2' ' A' ' 31' ' ' TRP . 73.3 mtm -71.76 -51.82 20.76 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.748 -0.66 . . . . 10.0 112.152 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -154.15 -79.29 0.1 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 117.595 0.18 . . . . 10.0 111.317 173.318 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 161.48 47.05 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.595 2.758 . . . . 10.0 110.68 -176.16 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.2 -88.58 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.478 0.918 . . . . 10.0 113.478 175.846 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.431 ' HE2' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.136 0 N-CA-C 115.205 1.557 . . . . 10.0 115.205 -172.061 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 114.036 1.125 . . . . 10.0 114.036 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.45 ' O ' HD13 ' A' ' 6' ' ' ILE . 47.4 t0 -143.5 -164.2 1.81 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.775 2.03 . . . . 10.0 107.193 -174.034 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.75 -44.26 4.07 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 127.29 2.236 . . . . 10.0 111.664 172.604 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -58.84 -48.35 81.65 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.941 -0.474 . . . . 10.0 111.649 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.44 -28.61 68.74 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.336 -0.852 . . . . 10.0 110.96 -177.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.45 HD13 ' O ' ' A' ' 2' ' ' ASP . 1.4 mp -69.24 -51.65 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.128 -1.064 . . . . 10.0 108.128 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.431 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.4 OUTLIER -68.34 -41.95 79.99 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 118.026 -1.47 . . . . 10.0 111.747 177.093 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -67.97 -22.11 65.04 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.956 1.702 . . . . 10.0 112.778 -176.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.58 -28.42 16.04 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.838 1.051 . . . . 10.0 113.838 167.383 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -105.73 -67.77 0.91 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.131 0.972 . . . . 10.0 112.057 -171.051 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.431 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.04 41.86 0.3 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 125.251 1.42 . . . . 10.0 110.365 -179.029 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -128.46 -7.11 5.23 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 125.657 1.583 . . . . 10.0 113.283 -167.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.2 t -94.52 -39.97 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.134 0.973 . . . . 10.0 108.54 -176.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.7 m -106.93 -55.71 2.29 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.779 1.632 . . . . 10.0 110.629 -172.055 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' HIS . . . . . 0.445 ' CE1' ' HG2' ' A' ' 23' ' ' PRO . 20.0 m-70 -75.19 -19.67 59.69 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.665 1.357 . . . . 10.0 114.665 -172.482 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m -65.45 -51.64 58.76 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.464 0.705 . . . . 10.0 110.237 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.71 -34.59 10.47 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.092 1.357 . . . . 10.0 111.595 -177.259 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.09 57.74 1.0 Allowed Glycine 0 CA--C 1.537 1.451 0 C-N-CA 126.296 1.903 . . . . 10.0 112.508 -174.161 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 18.5 t -94.9 153.68 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 124.769 1.227 . . . . 10.0 110.435 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.09 20.84 5.85 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.241 1.416 . . . . 10.0 113.528 -177.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.9 22.31 69.27 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.561 1.077 . . . . 10.0 113.571 -173.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.69 143.14 94.69 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 118.516 1.158 . . . . 10.0 112.606 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.445 ' HG2' ' CE1' ' A' ' 15' ' ' HIS . 96.4 Cg_endo -74.22 146.99 36.93 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 124.776 3.651 . . . . 10.0 110.571 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -74.54 135.45 42.15 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.812 -0.555 . . . . 10.0 111.657 -167.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.66 -34.12 4.81 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.651 1.18 . . . . 10.0 113.472 178.109 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 48.8 p-80 -125.32 103.57 8.0 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.803 1.641 . . . . 10.0 108.971 170.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -141.24 161.8 37.02 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 107.182 -1.414 . . . . 10.0 107.182 170.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 59.7 m -109.94 -35.6 6.1 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.408 0.549 . . . . 10.0 111.35 171.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.48 -12.65 45.38 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.295 -0.878 . . . . 10.0 113.293 -177.173 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.446 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 13.7 t0 -88.58 -25.77 22.31 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.641 1.576 . . . . 10.0 109.898 174.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.467 ' CZ3' ' OXT' ' A' ' 78' ' ' LYS . 63.4 m95 -96.68 -35.06 11.15 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.719 1.608 . . . . 10.0 111.095 -179.368 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.07 -52.64 19.14 Favored Pre-proline 0 CA--C 1.549 0.941 0 N-CA-C 114.694 1.368 . . . . 10.0 114.694 169.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -74.83 16.18 0.66 Allowed 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.933 2.422 . . . . 10.0 113.641 -179.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 -122.07 -45.05 2.26 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.78 2.032 . . . . 10.0 108.827 176.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.519 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -59.41 0.96 0.09 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.054 1.742 . . . . 10.0 114.433 166.877 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -81.11 -27.08 35.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.98 1.312 . . . . 10.0 109.842 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -90.42 -57.08 2.96 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.4 0.68 . . . . 10.0 110.492 173.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 148.9 -115.69 0.75 Allowed Glycine 0 CA--C 1.531 1.083 0 C-N-CA 123.845 0.736 . . . . 10.0 111.279 174.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.52 173.79 13.47 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.163 0 C-N-CA 125.064 1.346 . . . . 10.0 110.893 171.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.258 16.0 m-20 69.3 -27.51 0.16 Allowed 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 125.48 1.512 . . . . 10.0 112.877 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.67 -26.86 68.86 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.014 -1.678 . . . . 10.0 113.859 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -99.55 -38.51 8.73 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.623 0.769 . . . . 10.0 111.07 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -54.52 -33.99 27.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 122.015 -0.428 . . . . 10.0 110.25 172.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 ptmt -59.11 -46.97 86.96 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.916 1.08 . . . . 10.0 113.916 169.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 55.5 m -68.53 -28.38 66.93 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 120.59 -1.319 . . . . 10.0 110.547 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.3 t -60.24 -54.06 40.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 O-C-N 121.657 -0.652 . . . . 10.0 111.481 170.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -33.84 73.5 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 111.951 0.352 . . . . 10.0 111.951 177.327 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.03 -35.39 66.76 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.514 0.561 . . . . 10.0 112.514 -178.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.74 112.67 0.21 Allowed Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.255 -0.738 . . . . 10.0 111.255 -167.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.6 -155.23 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.578 0.751 . . . . 10.0 110.523 170.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -73.13 -66.58 0.66 Allowed 'General case' 0 N--CA 1.475 0.802 0 O-C-N 119.67 -1.894 . . . . 10.0 111.608 -173.521 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.31 -16.51 61.37 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.508 1.123 . . . . 10.0 112.118 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.2 ttp -100.77 118.05 61.45 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 123.237 0.615 . . . . 10.0 111.826 -172.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.02 154.3 70.92 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.115 1.876 . . . . 10.0 111.926 -173.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -59.58 124.8 16.22 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 123.991 3.127 . . . . 10.0 110.973 -177.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.89 43.03 8.49 Favored Glycine 0 C--N 1.34 0.793 0 CA-C-O 118.954 -0.914 . . . . 10.0 111.249 -172.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 17.6 57.73 0.01 OUTLIER Glycine 0 CA--C 1.531 1.088 0 C-N-CA 126.976 2.227 . . . . 10.0 115.422 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 72.34 -51.98 0.7 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.003 1.321 . . . . 10.0 112.972 -172.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.6 p -79.63 87.57 5.18 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 173.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 68.3 p -55.79 -50.07 71.47 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.399 -0.813 . . . . 10.0 111.124 171.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -78.32 63.24 3.16 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.824 1.65 . . . . 10.0 110.166 178.72 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 2.9 m -131.12 122.84 27.38 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.863 1.265 . . . . 10.0 111.073 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.0 m -90.83 141.72 28.52 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 124.765 1.226 . . . . 10.0 109.368 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -43.07 -38.18 2.25 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.32 1.23 . . . . 10.0 114.32 177.315 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -47.81 -58.52 4.25 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.225 1.01 . . . . 10.0 112.417 169.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -74.52 -40.87 61.48 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.901 1.281 . . . . 10.0 110.168 -178.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -57.09 14.08 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.024 0.929 . . . . 10.0 109.811 178.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -51.53 68.28 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.688 1.195 . . . . 10.0 110.036 -177.203 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.4 -33.76 55.08 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.354 -0.841 . . . . 10.0 112.709 170.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.58 -31.73 47.35 Favored 'General case' 0 C--N 1.341 0.222 0 O-C-N 121.013 -1.055 . . . . 10.0 111.487 -175.235 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.489 HG12 ' OXT' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -78.81 -50.42 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-O 121.775 0.797 . . . . 10.0 109.471 173.953 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -53.68 -31.71 48.88 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.203 1.401 . . . . 10.0 112.17 176.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -49.82 -58.08 6.09 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 124.568 1.147 . . . . 10.0 112.197 172.297 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.431 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 4.9 mpp? -64.17 -57.05 10.68 Favored 'General case' 0 C--N 1.34 0.194 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 177.822 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -177.09 129.45 0.17 Allowed 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.519 -1.289 . . . . 10.0 107.519 174.073 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.02 74.16 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.587 1.955 . . . . 10.0 113.185 172.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.519 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -163.99 -65.4 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.484 1.514 . . . . 10.0 113.757 -171.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.489 ' OXT' HG12 ' A' ' 71' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.712 0 N-CA-C 116.006 1.854 . . . . 10.0 116.006 -165.597 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.466 0.329 0 N-CA-C 114.123 1.157 . . . . 10.0 114.123 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -146.97 117.37 7.43 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 -177.317 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -45.2 -40.58 7.41 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.529 1.131 . . . . 10.0 113.743 173.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -60.48 -49.64 76.74 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.356 -0.215 . . . . 10.0 110.667 172.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.55 -30.69 70.4 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.557 -0.715 . . . . 10.0 111.303 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 15.8 mt -66.73 -52.79 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.437 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.3 OUTLIER -68.56 -40.92 80.43 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 117.921 -1.511 . . . . 10.0 111.16 -179.372 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -69.04 -21.95 64.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.041 1.737 . . . . 10.0 113.273 -178.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.14 -29.08 15.33 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 121.21 -0.931 . . . . 10.0 113.172 168.599 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.72 -66.72 1.01 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.356 1.062 . . . . 10.0 112.78 -171.162 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.437 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.04 39.64 0.19 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.116 1.366 . . . . 10.0 110.757 179.169 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -125.12 3.37 7.92 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.797 1.239 . . . . 10.0 113.62 -167.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.3 t -105.84 -52.55 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 124.71 1.204 . . . . 10.0 108.249 -174.179 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.5 m -84.49 -62.53 1.53 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.559 1.544 . . . . 10.0 111.08 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 72.4 m-70 -73.92 -23.87 59.6 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.943 1.46 . . . . 10.0 114.943 -167.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.42 -46.78 87.76 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.152 0.581 . . . . 10.0 110.456 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -109.51 -22.21 12.1 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.847 0.859 . . . . 10.0 111.871 -176.481 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.46 57.34 1.88 Allowed Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.032 0.825 . . . . 10.0 112.019 -175.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 46.4 t -103.34 161.24 4.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 125.375 1.47 . . . . 10.0 109.396 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.33 22.05 10.38 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.089 0.956 . . . . 10.0 113.163 -175.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 73.69 16.4 79.17 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 124.157 0.884 . . . . 10.0 113.199 -173.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.15 144.18 98.15 Favored Pre-proline 0 CA--C 1.543 0.699 0 CA-C-N 118.262 1.031 . . . . 10.0 113.366 -174.179 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -76.28 139.1 20.75 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 124.249 3.299 . . . . 10.0 111.015 -176.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 mttt -62.54 143.81 56.79 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.524 0.564 . . . . 10.0 112.524 -165.184 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t -49.14 -35.29 16.19 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.436 1.094 . . . . 10.0 113.511 177.256 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -142.01 57.78 1.48 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.829 0.852 . . . . 10.0 112.277 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -79.35 165.46 23.11 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 165.317 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.2 p -107.95 -35.91 6.5 Favored 'General case' 0 C--O 1.222 -0.377 0 O-C-N 121.67 -0.643 . . . . 10.0 111.417 164.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.06 -22.01 56.13 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 120.557 -1.34 . . . . 10.0 113.203 -176.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -87.78 -23.4 24.08 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.396 2.278 . . . . 10.0 110.259 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.537 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 43.7 m95 -97.28 -36.8 10.29 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.053 1.741 . . . . 10.0 110.776 178.6 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -41.64 -59.79 2.26 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.27 1.428 . . . . 10.0 114.037 174.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -64.04 -10.87 24.75 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 122.613 2.209 . . . . 10.0 113.833 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -96.43 -47.77 5.84 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.506 1.122 . . . . 10.0 110.084 176.402 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -17.58 64.75 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.442 1.897 . . . . 10.0 112.407 179.577 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -82.36 -38.05 24.77 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 125.026 1.33 . . . . 10.0 109.097 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt -68.01 -49.76 59.61 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.534 171.211 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 162.59 -132.9 2.91 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 112.142 -0.383 . . . . 10.0 112.142 178.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.3 t -137.86 -54.02 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 C-N-CA 123.875 0.87 . . . . 10.0 109.975 179.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -74.38 34.5 0.09 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.456 1.502 . . . . 10.0 113.251 -177.269 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.512 ' HB2' HD22 ' A' ' 42' ' ' LEU . 1.2 m120 -111.08 -54.74 2.57 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.762 2.425 . . . . 10.0 106.27 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.512 HD22 ' HB2' ' A' ' 41' ' ' ASN . 4.0 mm? -77.15 -32.52 56.35 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.481 -0.762 . . . . 10.0 110.552 -175.497 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.95 -15.3 16.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 O-C-N 121.929 -0.482 . . . . 10.0 111.566 171.707 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -85.96 -49.11 8.1 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.421 0.688 . . . . 10.0 111.102 168.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.8 m -58.59 -38.87 78.86 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 120.428 1.467 . . . . 10.0 110.64 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.7 p -62.0 -42.94 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-O 121.425 0.631 . . . . 10.0 110.963 -178.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.8 -30.42 51.23 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.762 0.825 . . . . 10.0 111.922 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 53.4 m -74.63 -25.45 59.23 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.438 1.095 . . . . 10.0 112.618 176.336 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.97 115.16 0.34 Allowed Glycine 0 CA--C 1.529 0.912 0 CA-C-N 119.486 1.039 . . . . 10.0 111.99 -175.457 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.3 tp -105.77 -145.74 0.38 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.518 0.727 . . . . 10.0 111.008 177.336 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -80.27 141.66 35.32 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 122.566 1.175 . . . . 10.0 108.768 174.614 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 55.72 22.09 5.16 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 112.183 -2.281 . . . . 10.0 111.953 173.183 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.6 ttp -144.64 123.3 6.84 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.516 1.127 . . . . 10.0 110.571 -174.504 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.45 148.39 48.29 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 121.881 1.721 . . . . 10.0 112.038 -173.147 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -62.95 113.66 2.1 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 123.648 2.899 . . . . 10.0 110.189 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 114.7 -10.6 21.31 Favored Glycine 0 CA--C 1.529 0.929 0 O-C-N 123.566 0.541 . . . . 10.0 112.668 -170.635 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.07 49.48 78.03 Favored Glycine 0 CA--C 1.534 1.234 0 O-C-N 120.429 -1.63 . . . . 10.0 109.999 -175.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 76.39 -45.54 0.51 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.462 1.905 . . . . 10.0 112.812 -177.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.0 p -76.86 159.57 29.94 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.215 -0.928 . . . . 10.0 111.279 177.568 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 34.1 p -110.05 -69.43 0.86 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.315 1.046 . . . . 10.0 110.38 -177.403 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -78.87 54.68 1.6 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.882 1.273 . . . . 10.0 110.602 -179.292 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -86.22 115.83 24.03 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.443 1.097 . . . . 10.0 111.086 -176.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 50.0 m -91.69 126.94 36.95 Favored 'General case' 0 C--O 1.231 0.09 0 N-CA-C 108.568 -0.901 . . . . 10.0 108.568 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -43.96 -34.4 1.68 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.299 1.439 . . . . 10.0 113.174 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -43.81 -66.78 0.34 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.464 1.105 . . . . 10.0 113.275 163.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.67 -29.24 62.2 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.329 -0.857 . . . . 10.0 110.081 -177.277 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.03 -52.62 64.19 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.807 0.813 . . . . 10.0 111.358 179.232 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -66.69 -47.1 73.49 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-O 117.804 -1.093 . . . . 10.0 109.296 176.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.15 -29.67 5.74 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 120.097 1.317 . . . . 10.0 113.524 171.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.24 -36.61 22.59 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.397 1.079 . . . . 10.0 112.131 -177.626 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.0 mt -81.63 -47.55 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.86 1.264 . . . . 10.0 111.8 176.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.25 -34.7 33.61 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.336 1.454 . . . . 10.0 112.443 172.77 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -44.24 -39.71 4.64 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.785 0.834 . . . . 10.0 112.523 173.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.537 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -82.5 -70.43 0.55 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 122.771 0.428 . . . . 10.0 111.962 -178.456 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 t -161.34 32.48 0.14 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.674 0.79 . . . . 10.0 112.488 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.8 pttt 36.94 57.74 1.17 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.457 1.503 . . . . 10.0 114.588 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.05 -52.65 0.37 Allowed 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 113.841 1.052 . . . . 10.0 113.841 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.407 ' O ' ' NZ ' ' A' ' 78' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.911 0 C-N-CA 125.165 1.386 . . . . 10.0 113.443 -166.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.532 0.266 0 N-CA-C 114.165 1.172 . . . . 10.0 114.165 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 3' ' ' ALA . 15.6 t70 -144.47 -153.39 0.47 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.958 1.303 . . . . 10.0 108.321 -174.184 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.407 ' H ' ' CG ' ' A' ' 2' ' ' ASP . . . -127.82 -40.4 1.72 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 128.335 2.654 . . . . 10.0 111.443 177.148 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -56.49 -46.69 80.35 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.449 0.642 . . . . 10.0 110.47 175.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.96 -31.52 72.15 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.877 -0.514 . . . . 10.0 110.746 -178.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.3 mp -69.3 -52.34 34.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 N-CA-C 107.983 -1.117 . . . . 10.0 107.983 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.485 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -68.27 -39.47 82.15 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 118.181 -1.408 . . . . 10.0 111.325 -179.148 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -69.39 -22.83 63.68 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.204 1.402 . . . . 10.0 113.003 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.64 -30.98 16.04 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.667 0.988 . . . . 10.0 113.667 167.809 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.01 -64.89 1.21 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.24 1.016 . . . . 10.0 111.946 -166.595 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.485 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.74 41.2 0.2 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.627 1.171 . . . . 10.0 110.912 177.43 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -128.81 0.25 5.39 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 125.66 1.584 . . . . 10.0 113.631 -166.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.5 t -101.97 -51.11 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 124.62 1.168 . . . . 10.0 108.199 -176.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.6 m -88.67 -64.1 1.2 Allowed 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.119 1.768 . . . . 10.0 109.933 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.3 m-70 -73.65 -11.19 60.34 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.05 1.5 . . . . 10.0 115.05 -166.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.35 -36.68 63.62 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.124 0.97 . . . . 10.0 110.908 178.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -125.23 -37.42 2.4 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.753 1.221 . . . . 10.0 112.24 -172.419 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.35 64.15 1.17 Allowed Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.75 1.643 . . . . 10.0 112.909 175.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 73.5 t -84.67 -56.66 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 123.657 0.783 . . . . 10.0 111.925 -176.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.1 33.23 0.44 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.941 0.897 . . . . 10.0 111.128 177.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 63.59 21.8 65.25 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 124.497 1.046 . . . . 10.0 113.258 -174.117 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.97 137.95 97.14 Favored Pre-proline 0 CA--C 1.545 0.756 0 O-C-N 121.813 -0.816 . . . . 10.0 112.564 -174.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -70.08 135.55 29.96 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.645 2.897 . . . . 10.0 110.3 -175.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.5 mtmm -53.58 133.62 41.26 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.155 -0.966 . . . . 10.0 112.578 -171.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.4 p -55.68 -14.16 2.07 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.824 1.046 . . . . 10.0 113.824 173.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -145.82 45.65 1.27 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.436 1.094 . . . . 10.0 111.848 177.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.424 ' HB3' ' HB2' ' A' ' 30' ' ' ASP . 1.3 t-20 -76.64 167.95 20.94 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.407 -0.808 . . . . 10.0 109.82 166.492 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.7 t -109.15 -35.65 6.25 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.875 -0.516 . . . . 10.0 111.53 161.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.83 -21.14 51.94 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.181 -1.574 . . . . 10.0 113.345 -174.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.424 ' HB2' ' HB3' ' A' ' 27' ' ' ASN . 0.5 OUTLIER -82.77 -26.69 31.63 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.08 2.152 . . . . 10.0 110.006 177.063 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.493 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 41.0 m95 -94.5 -36.34 11.9 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.841 1.656 . . . . 10.0 110.846 -177.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -45.33 -56.78 8.66 Favored Pre-proline 0 CA--C 1.545 0.778 0 O-C-N 120.811 -1.181 . . . . 10.0 113.635 174.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -76.47 21.57 0.55 Allowed 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.167 2.578 . . . . 10.0 113.133 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.423 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 1.8 mmp_? -125.37 -47.98 1.71 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.582 1.953 . . . . 10.0 109.02 175.733 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -19.66 47.14 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.799 2.44 . . . . 10.0 112.036 173.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.41 -28.45 37.81 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 124.526 1.131 . . . . 10.0 110.124 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.6 mmmt -74.93 -51.26 14.23 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 174.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.3 -117.34 0.77 Allowed Glycine 0 CA--C 1.531 1.06 0 C-N-CA 124.686 1.136 . . . . 10.0 110.403 177.656 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.01 -56.64 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 124.294 1.038 . . . . 10.0 110.764 177.606 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.49 17.17 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.486 1.115 . . . . 10.0 113.371 -176.812 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -97.89 -22.97 16.04 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 125.754 1.621 . . . . 10.0 110.526 177.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -104.43 -43.14 5.26 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.338 1.055 . . . . 10.0 110.031 -175.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -54.36 -33.22 25.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 O-C-N 121.72 -0.613 . . . . 10.0 111.151 171.434 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -63.68 -43.45 96.63 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.217 -0.927 . . . . 10.0 113.112 172.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.7 m -66.16 -34.15 77.4 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.203 -0.935 . . . . 10.0 110.371 177.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.414 ' HA ' ' HE3' ' A' ' 53' ' ' MET . 31.3 t -56.87 -54.86 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 122.491 0.317 . . . . 10.0 110.995 174.493 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -35.08 68.91 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.952 0.723 . . . . 10.0 112.952 175.785 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 22.6 m -71.58 -36.13 70.78 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.05 0.54 . . . . 10.0 111.999 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.48 95.68 0.6 Allowed Glycine 0 CA--C 1.528 0.904 0 CA-C-N 118.862 0.756 . . . . 10.0 111.23 -174.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.1 tp -60.13 169.39 1.58 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 122.138 0.971 . . . . 10.0 111.839 173.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -50.32 -55.95 13.35 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.71 -1.244 . . . . 10.0 112.603 -174.039 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -95.29 20.39 9.36 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 113.799 -1.546 . . . . 10.0 112.073 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' MET . . . . . 0.414 ' HE3' ' HA ' ' A' ' 46' ' ' VAL . 39.7 ttp -129.08 130.63 23.42 Favored Pre-proline 0 CA--C 1.551 1.019 0 N-CA-C 114.478 1.288 . . . . 10.0 114.478 175.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -64.02 157.43 53.1 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 121.992 1.794 . . . . 10.0 112.182 177.497 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -60.12 137.0 72.66 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.791 2.327 . . . . 10.0 110.118 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 62.16 27.9 69.8 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-O 118.927 -0.93 . . . . 10.0 113.756 -175.714 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 48.21 33.85 11.63 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.128 1.347 . . . . 10.0 113.782 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 71.15 45.58 0.49 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.973 1.309 . . . . 10.0 112.077 -175.506 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.8 t -125.5 -52.6 1.6 Allowed 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.592 -0.693 . . . . 10.0 111.669 163.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.9 m 70.2 -69.47 0.17 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.993 1.317 . . . . 10.0 110.818 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -84.16 55.06 3.17 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.878 0.871 . . . . 10.0 110.699 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.3 m -114.65 140.56 48.73 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.354 1.462 . . . . 10.0 109.644 173.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 59.9 m -101.78 146.55 27.62 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.525 1.13 . . . . 10.0 109.492 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -41.92 -39.84 1.97 Allowed 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 115.063 1.505 . . . . 10.0 115.063 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -42.71 -63.59 0.76 Allowed 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.758 1.163 . . . . 10.0 112.607 167.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.82 -40.05 63.62 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.541 1.936 . . . . 10.0 109.613 -175.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -59.12 5.83 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.923 0.889 . . . . 10.0 110.065 178.02 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt -59.16 -46.29 88.77 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.525 1.13 . . . . 10.0 109.411 178.357 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.01 -26.48 37.28 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.3 -0.875 . . . . 10.0 112.415 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.85 -6.64 57.2 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 125.212 1.405 . . . . 10.0 112.648 -174.226 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.51 -40.27 4.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 125.447 1.499 . . . . 10.0 110.335 167.482 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.81 -40.71 76.47 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.71 0.804 . . . . 10.0 111.108 175.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -52.64 -36.8 57.34 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.893 0.701 . . . . 10.0 112.893 176.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.493 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 2.6 mpp? -75.3 -66.03 0.82 Allowed 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 121.819 -0.55 . . . . 10.0 111.562 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -166.53 35.37 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 119.569 -0.853 . . . . 10.0 112.519 -178.37 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt 37.29 51.65 1.13 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.861 0.864 . . . . 10.0 113.301 -176.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.423 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -141.3 -82.93 0.21 Allowed 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.012 1.116 . . . . 10.0 114.012 170.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.984 0 N-CA-C 115.733 1.753 . . . . 10.0 115.733 -164.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 . . . . . 0 N--CA 1.461 0.11 0 N-CA-C 113.081 0.771 . . . . 10.0 113.081 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -141.24 127.42 19.65 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.995 -1.113 . . . . 10.0 107.995 172.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.96 -36.99 75.75 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.965 0.906 . . . . 10.0 112.003 175.082 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -61.94 -48.41 80.53 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 120.401 -0.52 . . . . 10.0 110.934 172.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.08 -31.0 71.61 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 121.34 -0.85 . . . . 10.0 109.848 -177.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 mm -65.77 -52.78 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 117.698 -1.144 . . . . 10.0 109.248 173.458 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.406 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.5 OUTLIER -68.17 -39.55 82.52 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 121.258 1.844 . . . . 10.0 112.153 -178.541 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -69.74 -22.32 63.38 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.288 2.235 . . . . 10.0 111.926 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.89 -27.12 15.33 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.035 1.124 . . . . 10.0 114.035 166.775 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -104.98 -70.67 0.77 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.131 1.372 . . . . 10.0 112.557 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.406 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.49 42.07 0.27 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.937 1.695 . . . . 10.0 110.418 -178.775 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.0 t -127.48 -5.49 5.91 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 125.172 1.389 . . . . 10.0 113.677 -164.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 42.1 t -95.87 -53.5 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 CA-C-O 122.311 1.053 . . . . 10.0 108.167 -175.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 29.2 m -93.04 -55.24 3.41 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.525 1.53 . . . . 10.0 109.261 -171.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -72.76 -19.8 61.3 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.677 1.191 . . . . 10.0 113.334 -172.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.9 t -63.62 -49.6 72.67 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.18 0.592 . . . . 10.0 110.879 -178.778 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.7 tpt -112.08 -27.21 8.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.332 1.053 . . . . 10.0 112.977 -177.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.64 58.62 2.01 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 124.781 1.181 . . . . 10.0 112.859 -177.774 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 96.2 t -82.63 -58.22 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 121.898 -0.766 . . . . 10.0 112.204 -175.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.55 32.01 0.41 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.873 0.869 . . . . 10.0 111.044 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 63.62 23.91 67.44 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 123.747 0.689 . . . . 10.0 112.832 -172.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.94 145.15 97.71 Favored Pre-proline 0 CA--C 1.544 0.731 0 O-C-N 121.769 -0.842 . . . . 10.0 111.142 176.957 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.94 144.86 35.01 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.73 2.953 . . . . 10.0 110.873 -174.147 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -65.53 138.31 57.97 Favored 'General case' 0 C--O 1.239 0.534 0 O-C-N 121.796 -0.565 . . . . 10.0 111.897 -171.083 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.6 m -19.58 -51.26 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 128.189 2.596 . . . . 10.0 115.206 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -144.68 53.1 1.24 Allowed 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.999 0.428 . . . . 10.0 111.45 173.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -53.34 153.79 3.73 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.348 -0.845 . . . . 10.0 110.105 164.842 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 94.2 m -100.6 -35.56 9.46 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.203 -0.936 . . . . 10.0 111.001 169.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.09 -23.37 28.53 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 120.966 -1.084 . . . . 10.0 112.595 -171.775 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -81.71 -32.88 31.43 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.119 1.768 . . . . 10.0 109.768 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 43.6 m95 -85.08 -35.45 21.82 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.313 1.845 . . . . 10.0 111.459 178.389 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -42.64 -58.77 3.43 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 114.349 1.24 . . . . 10.0 114.349 174.553 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -73.27 15.58 0.5 Allowed 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 123.209 2.606 . . . . 10.0 113.743 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.03 -49.71 2.5 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.81 1.644 . . . . 10.0 108.95 173.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.9 mt -54.65 -12.01 0.68 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.407 1.483 . . . . 10.0 114.38 170.431 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.91 -37.16 16.69 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 125.117 1.367 . . . . 10.0 110.019 -173.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.0 mtpt -77.98 -47.07 19.37 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 166.63 -126.2 1.43 Allowed Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.892 -0.883 . . . . 10.0 110.892 173.373 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 86.5 t -138.62 -64.57 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 C-N-CA 123.399 0.68 . . . . 10.0 110.96 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.13 -35.7 59.99 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 119.065 -0.493 . . . . 10.0 111.373 -174.244 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -33.68 -42.22 0.11 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.742 1.217 . . . . 10.0 112.566 171.124 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -81.37 -42.6 20.25 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.744 1.218 . . . . 10.0 112.524 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -53.52 -33.95 22.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 O-C-N 121.078 -1.014 . . . . 10.0 110.981 169.128 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -44.31 96.98 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.394 -0.817 . . . . 10.0 112.622 169.594 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.6 m -61.47 -37.32 83.19 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 120.598 -1.314 . . . . 10.0 110.249 174.53 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 7.0 t -63.6 -55.1 24.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 122.866 0.466 . . . . 10.0 111.592 -178.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.03 -32.62 64.19 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 176.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.3 m -72.23 -30.0 64.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.936 0.895 . . . . 10.0 112.077 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 74.97 94.64 0.14 Allowed Glycine 0 CA--C 1.53 0.983 0 CA-C-N 118.98 0.809 . . . . 10.0 111.903 -176.355 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.2 tp -65.0 170.5 4.32 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.93 -0.747 . . . . 10.0 111.696 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -48.84 -58.19 5.21 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.612 -1.305 . . . . 10.0 112.946 -170.563 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.03 24.92 5.14 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.15 1.38 . . . . 10.0 112.768 173.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 35.3 ttp -132.01 127.19 21.0 Favored Pre-proline 0 CA--C 1.554 1.097 0 N-CA-C 114.5 1.296 . . . . 10.0 114.5 172.212 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.09 157.34 53.89 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 122.035 1.823 . . . . 10.0 112.937 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -64.78 129.92 24.74 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 123.663 2.908 . . . . 10.0 110.593 -175.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.02 25.46 74.67 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 121.575 -0.345 . . . . 10.0 112.429 -170.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.16 -46.3 2.7 Favored Glycine 0 CA--C 1.534 1.24 0 O-C-N 121.369 -1.077 . . . . 10.0 114.178 170.176 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -174.13 -48.27 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.387 2.275 . . . . 10.0 109.997 171.669 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.8 t -79.56 131.49 36.03 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.724 1.61 . . . . 10.0 110.9 177.374 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.5 m -89.54 -50.0 6.35 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 122.027 0.917 . . . . 10.0 110.212 173.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -78.88 60.6 2.9 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.725 2.41 . . . . 10.0 110.064 179.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 21.4 m -134.3 148.32 50.75 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.98 1.712 . . . . 10.0 110.615 174.118 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 59.4 m -108.93 155.78 20.45 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.639 1.576 . . . . 10.0 109.859 -178.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -46.17 -40.66 11.51 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.438 1.095 . . . . 10.0 112.99 177.326 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -57.12 -47.47 81.02 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.611 -0.68 . . . . 10.0 111.868 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.32 -44.07 63.22 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.812 -0.811 . . . . 10.0 108.812 -179.41 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -55.71 -49.95 71.63 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.266 0.555 . . . . 10.0 111.955 176.515 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -67.75 -52.55 36.07 Favored 'General case' 0 C--O 1.218 -0.603 0 CA-C-O 118.071 -0.966 . . . . 10.0 108.777 -176.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.39 -39.3 15.01 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.736 1.153 . . . . 10.0 112.859 171.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.05 -50.26 50.11 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.387 -0.821 . . . . 10.0 110.825 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 51.2 mt -58.31 -37.74 65.04 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.026 0 C-N-CA 125.498 1.519 . . . . 10.0 112.212 172.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -68.41 -38.22 81.05 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 126.778 2.031 . . . . 10.0 111.596 175.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -52.03 -36.18 49.35 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.538 0.57 . . . . 10.0 112.538 172.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 66.1 mtm -80.45 -71.97 0.43 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.777 0.831 . . . . 10.0 112.633 -179.12 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 7.0 t -162.96 45.59 0.13 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.742 -0.599 . . . . 10.0 111.78 172.5 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.2 ptpt 36.11 57.98 0.99 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.048 1.739 . . . . 10.0 114.948 176.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.21 -80.01 0.04 OUTLIER 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 112.425 0.528 . . . . 10.0 112.425 171.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.254 1.312 0 N-CA-C 116.005 1.854 . . . . 10.0 116.005 -169.083 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.338 0 N-CA-C 111.95 0.352 . . . . 10.0 111.95 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -143.85 125.22 14.72 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.775 1.23 . . . . 10.0 108.217 172.26 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -49.54 -39.24 33.84 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.36 1.064 . . . . 10.0 112.558 170.026 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -59.97 -45.06 93.92 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 122.365 -0.209 . . . . 10.0 111.175 171.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.6 -34.25 76.63 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.366 -0.834 . . . . 10.0 110.667 -179.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.6 mt -64.37 -52.75 51.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 N-CA-C 108.432 -0.951 . . . . 10.0 108.432 178.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.45 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.65 -39.83 76.85 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 117.962 -1.495 . . . . 10.0 111.998 -178.147 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -68.46 -22.6 64.56 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.118 1.367 . . . . 10.0 112.45 -177.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.65 -28.73 15.82 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.444 0.905 . . . . 10.0 113.444 170.318 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.03 -67.7 0.96 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.854 0.862 . . . . 10.0 112.373 -171.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.45 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.78 45.07 0.4 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 125.119 1.368 . . . . 10.0 110.159 -178.574 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.9 t -125.91 -15.13 5.98 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 120.495 -1.378 . . . . 10.0 113.859 -162.073 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.427 HG23 ' SG ' ' A' ' 14' ' ' CYS . 0.9 OUTLIER -95.02 -30.36 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.596 1.158 . . . . 10.0 109.1 -175.328 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.427 ' SG ' HG23 ' A' ' 13' ' ' VAL . 96.1 m -107.4 -64.12 1.23 Allowed 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 128.254 2.622 . . . . 10.0 109.624 -173.688 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -74.8 -19.38 60.22 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.929 1.085 . . . . 10.0 113.929 -168.199 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.8 t -61.88 -50.67 71.27 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.502 0.721 . . . . 10.0 110.891 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.6 mmt -109.15 -13.96 14.58 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.311 1.444 . . . . 10.0 112.731 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.91 45.6 7.59 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.43 1.014 . . . . 10.0 112.087 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 91.9 t -90.52 159.88 2.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 124.855 1.262 . . . . 10.0 109.512 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.11 19.0 5.66 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.677 1.191 . . . . 10.0 113.754 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.62 7.38 75.46 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.555 1.074 . . . . 10.0 113.804 -175.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.53 147.87 96.83 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 118.403 1.101 . . . . 10.0 113.234 -172.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -68.46 164.09 34.1 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 123.677 2.918 . . . . 10.0 110.351 174.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -84.76 142.68 29.64 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.523 -0.736 . . . . 10.0 111.919 -176.858 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -45.84 -28.06 1.0 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.449 1.5 . . . . 10.0 113.837 172.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -135.31 125.01 25.28 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.867 0.867 . . . . 10.0 109.282 164.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -155.03 157.86 38.25 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.374 1.87 . . . . 10.0 106.496 172.56 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 75.7 m -108.39 -36.41 6.25 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.728 0.695 . . . . 10.0 111.464 171.409 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.28 -29.55 53.87 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.379 -0.825 . . . . 10.0 112.205 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -75.98 -34.58 59.77 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.392 1.477 . . . . 10.0 110.177 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.459 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 58.9 m95 -84.7 -34.06 23.02 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.752 2.021 . . . . 10.0 112.024 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -39.01 -61.73 0.89 Allowed Pre-proline 0 CA--C 1.546 0.797 0 N-CA-C 114.719 1.377 . . . . 10.0 114.719 173.768 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.32 -16.62 52.49 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.766 2.311 . . . . 10.0 113.265 -177.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.4 mmt180 -87.5 -51.68 5.78 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.886 1.274 . . . . 10.0 109.269 -179.043 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.36 -17.53 30.72 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.509 1.524 . . . . 10.0 113.413 174.283 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.16 -38.6 12.05 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 125.479 1.511 . . . . 10.0 109.97 -173.323 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -62.25 -51.67 66.79 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.145 -0.48 . . . . 10.0 109.806 167.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.7 -129.85 2.24 Favored Glycine 0 CA--C 1.533 1.174 0 N-CA-C 111.092 -0.803 . . . . 10.0 111.092 176.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 5.2 t -134.05 -58.03 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 123.848 0.859 . . . . 10.0 109.663 179.13 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.87 19.09 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.891 1.676 . . . . 10.0 114.63 -175.991 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -97.4 -26.22 14.94 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 127.591 2.356 . . . . 10.0 110.189 174.708 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -94.58 -47.48 6.51 Favored 'General case' 0 N--CA 1.445 -0.675 0 C-N-CA 123.694 0.797 . . . . 10.0 109.736 -175.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.512 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.6 OUTLIER -51.93 -32.92 15.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.657 1.183 . . . . 10.0 112.29 173.041 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -71.38 -37.56 71.57 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 120.427 -1.42 . . . . 10.0 112.838 172.026 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.474 ' HA ' HG22 ' A' ' 48' ' ' THR . 2.6 t -75.87 -36.06 59.67 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.582 1.553 . . . . 10.0 110.996 -175.111 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.512 HG12 ' HA ' ' A' ' 43' ' ' VAL . 8.8 p -65.92 -48.27 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 O-C-N 121.408 -0.807 . . . . 10.0 110.852 168.488 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -34.51 76.13 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.954 -0.698 . . . . 10.0 111.266 -176.049 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.474 HG22 ' HA ' ' A' ' 45' ' ' SER . 1.2 t -74.95 -32.61 61.78 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.798 -0.564 . . . . 10.0 112.018 174.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.5 112.1 1.0 Allowed Glycine 0 CA--C 1.532 1.144 0 C-N-CA 123.904 0.764 . . . . 10.0 112.684 -173.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.61 -175.51 4.39 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.68 0.792 . . . . 10.0 110.835 169.51 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -55.02 -64.44 0.83 Allowed 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.308 -1.495 . . . . 10.0 113.706 -162.458 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.52 8.1 6.98 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 115.598 -0.728 . . . . 10.0 112.5 173.148 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.19 138.91 19.68 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 114.113 1.153 . . . . 10.0 114.113 -175.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.38 140.42 52.76 Favored 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.094 1.862 . . . . 10.0 110.966 174.881 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -65.05 102.43 0.44 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.458 2.772 . . . . 10.0 109.649 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 110.35 12.37 17.54 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.342 0.496 . . . . 10.0 113.435 -175.07 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 56.15 34.75 62.91 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 118.663 1.232 . . . . 10.0 111.876 -177.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 73.59 -7.08 1.64 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.202 2.201 . . . . 10.0 114.074 -177.62 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.4 t -106.03 114.3 28.36 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.889 0.768 . . . . 10.0 112.113 -173.709 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 32.4 p -72.48 -53.4 12.22 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.321 1.048 . . . . 10.0 110.892 175.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -101.31 77.18 1.77 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.699 2.0 . . . . 10.0 109.024 177.428 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 12.0 m -123.87 132.63 53.79 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 121.572 -0.705 . . . . 10.0 110.844 161.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.8 p -79.25 163.27 25.09 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 122.159 -0.338 . . . . 10.0 110.198 171.053 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.98 -40.48 73.34 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.635 -0.666 . . . . 10.0 112.546 168.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.26 -51.83 63.31 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.728 0.695 . . . . 10.0 110.585 175.007 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -72.62 -36.6 68.11 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 122.23 -0.294 . . . . 10.0 111.34 -177.168 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -61.32 -52.17 65.81 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.749 -1.219 . . . . 10.0 111.334 173.16 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -63.37 -46.88 84.47 Favored 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 123.922 0.889 . . . . 10.0 109.823 -177.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.24 -40.86 49.01 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 121.323 0.582 . . . . 10.0 112.221 168.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.5 -39.82 70.57 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.865 -1.147 . . . . 10.0 112.051 -178.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.59 -55.49 19.58 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 124.078 0.951 . . . . 10.0 111.295 171.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -23.07 65.92 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 120.906 -1.121 . . . . 10.0 113.65 -177.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -43.69 -48.12 7.84 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.066 0.848 . . . . 10.0 111.364 168.087 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.459 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 3.6 mpp? -72.05 -50.02 31.86 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 112.228 0.455 . . . . 10.0 112.228 -179.249 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.84 -75.37 0.15 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.996 -0.526 . . . . 10.0 112.071 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 155.6 50.95 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 129.582 3.153 . . . . 10.0 111.589 -177.377 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -164.26 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.344 1.239 . . . . 10.0 114.344 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.27 0 N-CA-C 114.855 1.428 . . . . 10.0 114.855 -176.473 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 115.906 1.817 . . . . 10.0 115.906 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.444 ' O ' HD13 ' A' ' 6' ' ' ILE . 14.5 t70 -147.53 -160.4 1.16 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.563 1.545 . . . . 10.0 107.664 -174.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -117.51 -40.2 3.08 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 128.609 2.764 . . . . 10.0 111.469 177.352 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.21 -46.85 82.53 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.239 0.542 . . . . 10.0 110.203 174.24 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.9 -29.33 69.19 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.72 -0.613 . . . . 10.0 110.91 -175.078 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.444 HD13 ' O ' ' A' ' 2' ' ' ASP . 1.1 mp -67.92 -53.0 33.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 108.236 -1.024 . . . . 10.0 108.236 177.628 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.434 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.6 OUTLIER -68.44 -40.52 81.11 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 117.309 -1.756 . . . . 10.0 111.359 -178.762 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -69.61 -22.62 63.48 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.62 1.568 . . . . 10.0 113.164 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -96.38 -28.7 14.34 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.679 0.992 . . . . 10.0 113.679 170.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.47 -64.27 1.27 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.571 0.748 . . . . 10.0 112.011 -168.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.434 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.1 OUTLIER -73.92 29.13 0.08 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.591 1.157 . . . . 10.0 111.837 177.737 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -110.23 5.2 21.63 Favored 'General case' 0 CA--C 1.522 -0.124 0 O-C-N 120.583 -1.323 . . . . 10.0 113.984 -163.035 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 23.9 t -107.08 -44.4 7.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 125.048 1.339 . . . . 10.0 108.976 -172.076 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.7 m -95.85 -63.43 1.15 Allowed 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.92 2.088 . . . . 10.0 111.313 -177.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 35.9 m-70 -73.82 -23.26 59.63 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.606 0.965 . . . . 10.0 113.606 -167.155 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.1 t -58.47 -45.97 87.58 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.566 1.146 . . . . 10.0 111.041 -178.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 25.9 mmt -111.78 -20.55 12.03 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.983 1.313 . . . . 10.0 112.68 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.87 48.32 3.67 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 123.823 0.725 . . . . 10.0 112.16 -176.058 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 74.4 t -92.94 161.54 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 C-N-CA 125.107 1.363 . . . . 10.0 109.26 177.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.64 20.04 5.97 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.589 1.156 . . . . 10.0 113.328 -174.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 71.95 26.37 72.72 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.219 0.914 . . . . 10.0 113.293 -173.274 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.69 144.19 76.48 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 113.926 1.084 . . . . 10.0 113.926 -176.007 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -80.24 124.06 5.25 Favored 'Trans proline' 0 CA--C 1.537 0.646 1 C-N-CA 125.475 4.117 . . . . 10.0 111.759 -174.8 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -57.39 141.85 45.79 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 125.115 1.366 . . . . 10.0 112.485 -160.423 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.7 m -49.86 -56.94 8.52 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.532 0.568 . . . . 10.0 112.532 175.081 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -108.48 94.43 5.06 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 122.147 0.975 . . . . 10.0 111.098 178.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -135.72 166.5 23.13 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.226 1.41 . . . . 10.0 108.136 176.16 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.4 m -107.25 -38.59 5.93 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 118.259 0.482 . . . . 10.0 111.164 169.158 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.4 -16.15 47.02 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 120.868 -1.145 . . . . 10.0 113.22 -174.198 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -89.12 -23.49 22.47 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.199 1.8 . . . . 10.0 110.395 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 81.1 m95 -96.62 -36.0 10.87 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 126.443 1.897 . . . . 10.0 111.631 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -42.16 -58.64 3.28 Favored Pre-proline 0 CA--C 1.549 0.915 0 N-CA-C 114.436 1.272 . . . . 10.0 114.436 172.499 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.14 15.54 0.75 Allowed 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.517 2.812 . . . . 10.0 113.397 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.4 mmt85 -116.62 -45.42 2.8 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.555 1.542 . . . . 10.0 108.599 176.146 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.51 3.91 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.738 2.015 . . . . 10.0 114.916 165.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.02 -30.07 21.49 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.55 1.14 . . . . 10.0 110.289 177.442 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? -88.66 -56.04 3.46 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.902 0.481 . . . . 10.0 110.056 174.461 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.63 -122.33 1.11 Allowed Glycine 0 CA--C 1.531 1.089 0 C-N-CA 124.492 1.044 . . . . 10.0 110.526 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.5 -58.48 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 C-N-CA 124.181 0.992 . . . . 10.0 110.929 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.73 35.54 0.13 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.604 1.562 . . . . 10.0 113.369 -170.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -113.04 -57.65 2.26 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 128.017 2.527 . . . . 10.0 107.514 179.529 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mt -67.23 -29.5 69.16 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.916 1.286 . . . . 10.0 110.263 -175.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -55.69 -17.61 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 126.04 1.736 . . . . 10.0 113.743 168.568 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.9 mtmt -93.23 -43.38 8.85 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 172.068 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.457 ' HA ' HG22 ' A' ' 48' ' ' THR . 4.4 m -61.8 -32.3 72.58 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.121 0.962 . . . . 10.0 109.749 177.068 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.5 p -69.9 -38.52 75.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 170.425 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.4 -32.77 68.8 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.344 -0.848 . . . . 10.0 112.443 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.457 HG22 ' HA ' ' A' ' 45' ' ' SER . 10.1 t -75.47 -36.64 60.61 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.819 0.848 . . . . 10.0 113.211 173.684 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 82.77 117.66 0.56 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.607 -0.597 . . . . 10.0 111.607 -167.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.29 -150.87 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.268 0.627 . . . . 10.0 110.062 164.178 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -75.95 -67.23 0.7 Allowed 'General case' 0 N--CA 1.476 0.834 0 O-C-N 119.482 -2.011 . . . . 10.0 112.156 -172.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.68 -12.35 59.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.899 1.279 . . . . 10.0 111.919 174.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 mmm -78.24 129.31 75.62 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.151 0.58 . . . . 10.0 111.497 172.015 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.28 145.45 59.99 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 121.685 1.59 . . . . 10.0 110.071 176.767 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -61.59 130.06 30.2 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.656 2.237 . . . . 10.0 109.736 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.76 26.7 66.57 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 119.397 -1.382 . . . . 10.0 112.051 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 40.91 34.99 0.86 Allowed Glycine 0 CA--C 1.534 1.264 0 C-N-CA 126.123 1.821 . . . . 10.0 115.903 177.556 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.72 38.21 18.46 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.758 1.223 . . . . 10.0 112.868 -175.637 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -126.84 147.91 50.01 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.702 2.001 . . . . 10.0 109.666 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.7 m -116.15 -77.93 0.57 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.341 0.657 . . . . 10.0 110.245 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -79.1 46.3 0.69 Allowed 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.55 1.14 . . . . 10.0 111.055 -173.276 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 4.5 m -125.52 138.69 53.98 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.171 1.788 . . . . 10.0 110.918 -166.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 45.8 m -112.17 -103.33 0.4 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.979 0.809 . . . . 10.0 109.948 -171.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -139.74 -48.42 0.46 Allowed 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 124.568 1.147 . . . . 10.0 109.011 -178.004 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -43.84 -60.27 1.89 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 120.325 1.421 . . . . 10.0 113.854 175.413 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -74.32 -29.93 61.83 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.596 0.712 . . . . 10.0 110.217 -178.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -44.85 95.67 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.226 -0.921 . . . . 10.0 113.058 177.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -62.35 -56.34 19.28 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 124.547 1.139 . . . . 10.0 108.373 174.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.42 -33.34 30.07 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.76 -47.25 75.86 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.242 -0.911 . . . . 10.0 111.829 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -57.01 -47.83 82.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.702 0.801 . . . . 10.0 111.119 170.048 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -64.38 -36.39 83.98 Favored 'General case' 0 C--O 1.228 -0.074 0 O-C-N 121.243 -0.911 . . . . 10.0 113.192 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -49.57 -49.69 45.36 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.728 0.695 . . . . 10.0 111.088 176.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 75.8 mtm -66.45 -45.16 80.74 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.996 0.518 . . . . 10.0 112.39 -179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.56 -71.79 0.09 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 118.774 -0.632 . . . . 10.0 112.566 172.477 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt 152.21 57.87 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 130.073 3.349 . . . . 10.0 112.106 -178.346 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -170.56 -75.52 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 114.505 1.298 . . . . 10.0 114.505 170.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.3 pttp . . . . . 0 C--O 1.254 1.303 0 C-N-CA 125.666 1.586 . . . . 10.0 114.626 -172.571 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 . . . . . 0 N--CA 1.464 0.271 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -149.43 112.93 5.0 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.64 0.776 . . . . 10.0 110.027 178.822 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -32.17 -46.65 0.13 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.816 2.046 . . . . 10.0 115.158 162.221 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.0 tt0 -58.66 -48.58 80.58 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 118.833 0.742 . . . . 10.0 110.724 173.214 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.46 -33.98 76.23 Favored 'General case' 0 C--O 1.226 -0.159 0 O-C-N 121.893 -0.504 . . . . 10.0 110.327 -177.84 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.7 mm -65.83 -51.0 66.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-O 118.459 -0.781 . . . . 10.0 109.212 176.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.482 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -67.8 -40.41 83.89 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 117.686 -1.605 . . . . 10.0 111.445 -179.656 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -68.88 -23.38 64.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.389 1.476 . . . . 10.0 112.957 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -27.85 15.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.985 1.314 . . . . 10.0 112.831 171.802 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.71 -65.81 1.15 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.76 1.224 . . . . 10.0 113.456 -172.634 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.482 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.94 45.58 0.35 Allowed 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 124.159 0.984 . . . . 10.0 110.148 179.731 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.0 t -129.22 -15.14 4.21 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 120.459 -1.401 . . . . 10.0 113.856 -162.502 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 19.6 m -97.59 -42.83 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 C-N-CA 124.185 0.994 . . . . 10.0 109.552 -177.227 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.7 m -85.8 -64.34 1.17 Allowed 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 126.831 2.052 . . . . 10.0 110.262 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -73.49 -26.1 60.74 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.637 0.977 . . . . 10.0 113.637 -165.159 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.0 t -56.06 -49.27 74.24 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.896 0.878 . . . . 10.0 111.136 -178.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.0 mmt -112.88 -9.21 13.66 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.726 0.81 . . . . 10.0 112.445 -178.474 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.61 42.88 8.12 Favored Glycine 0 CA--C 1.533 1.197 0 O-C-N 121.575 -0.703 . . . . 10.0 111.896 -179.1 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 50.1 t -88.89 161.27 2.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 125.081 1.352 . . . . 10.0 109.12 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.7 18.16 4.59 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.42 1.088 . . . . 10.0 113.933 -175.653 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 84.54 11.55 77.35 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.69 1.138 . . . . 10.0 113.787 -176.113 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.08 152.09 94.78 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-N 118.702 1.251 . . . . 10.0 113.757 -174.148 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -76.75 138.42 18.92 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.12 2.546 . . . . 10.0 110.83 -176.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.62 127.38 22.73 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.226 1.01 . . . . 10.0 113.008 -173.356 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 91.0 p 0.84 -82.39 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 128.15 2.58 . . . . 10.0 115.349 171.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.6 p80 -144.66 110.95 5.55 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 122.073 0.939 . . . . 10.0 110.051 170.636 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -128.45 -178.37 4.54 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.589 1.556 . . . . 10.0 110.235 174.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.9 t -99.35 -32.79 10.99 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.333 0.515 . . . . 10.0 112.11 169.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.42 -53.48 57.07 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.585 -1.322 . . . . 10.0 114.306 -171.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -79.74 -21.86 43.98 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.622 0.725 . . . . 10.0 110.837 -178.717 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.442 ' HE3' ' HB3' ' A' ' 77' ' ' ALA . 71.9 m95 -79.64 -29.28 40.95 Favored 'General case' 0 CA--C 1.554 1.114 0 O-C-N 121.348 -0.845 . . . . 10.0 112.259 174.511 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -47.12 -61.41 2.85 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.641 1.576 . . . . 10.0 114.955 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -62.91 -16.39 53.61 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.186 1.924 . . . . 10.0 112.914 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.6 mmt85 -82.92 -46.43 12.97 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.766 1.226 . . . . 10.0 108.34 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.606 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -63.11 -17.9 62.83 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.381 1.872 . . . . 10.0 112.518 172.888 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.18 -33.15 26.26 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.452 1.101 . . . . 10.0 109.666 177.61 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -74.84 -51.62 13.5 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 122.236 0.215 . . . . 10.0 111.075 171.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 156.21 -104.52 0.25 Allowed Glycine 0 CA--C 1.531 1.082 0 C-N-CA 123.088 0.375 . . . . 10.0 112.626 170.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.54 -61.62 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 123.98 0.912 . . . . 10.0 110.439 175.672 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.408 ' HA ' HG12 ' A' ' 43' ' ' VAL . 0.9 OUTLIER -76.71 36.44 0.16 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.333 1.453 . . . . 10.0 113.096 -170.94 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -111.99 -54.1 2.64 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.786 -1.931 . . . . 10.0 105.786 -176.632 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -79.56 -33.71 41.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.201 1.0 . . . . 10.0 111.618 -177.592 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.408 HG12 ' HA ' ' A' ' 40' ' ' ASP . 0.5 OUTLIER -64.02 -11.21 9.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.65 -0.656 . . . . 10.0 111.8 170.756 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.6 mmpt? -78.78 -45.3 21.3 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.017 -1.052 . . . . 10.0 111.383 163.186 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 33.9 m -63.9 -38.27 90.45 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 120.294 -1.504 . . . . 10.0 110.766 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -56.57 -39.45 62.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 121.424 0.631 . . . . 10.0 111.968 177.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HA ' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -77.39 -29.66 53.25 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.003 0.521 . . . . 10.0 111.776 -179.811 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 99.2 m -73.11 -32.12 64.74 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.447 0.699 . . . . 10.0 112.623 175.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.12 111.54 0.92 Allowed Glycine 0 C--N 1.34 0.778 0 N-CA-C 110.327 -1.109 . . . . 10.0 110.327 -170.086 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.44 -163.18 0.09 Allowed 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.685 1.194 . . . . 10.0 109.278 162.571 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -74.12 -67.42 0.61 Allowed 'General case' 0 N--CA 1.476 0.826 0 O-C-N 119.888 -1.758 . . . . 10.0 112.492 -170.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.38 -33.9 77.04 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.217 1.007 . . . . 10.0 111.166 173.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -73.03 128.96 87.07 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 126.4 1.88 . . . . 10.0 112.086 -172.166 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.16 144.23 68.18 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 121.632 1.555 . . . . 10.0 110.135 177.478 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -61.27 126.38 19.23 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.551 2.167 . . . . 10.0 109.439 175.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.436 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 93.06 25.53 19.31 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 120.987 -0.625 . . . . 10.0 112.939 179.465 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.83 35.11 4.23 Favored Glycine 0 CA--C 1.543 1.837 0 CA-C-N 118.002 0.901 . . . . 10.0 114.507 -177.397 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 14.3 ttm 70.13 -4.04 1.64 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.247 2.219 . . . . 10.0 114.926 -176.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.51 -38.88 6.61 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.064 -1.023 . . . . 10.0 112.511 -179.096 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 72.9 m 67.38 -60.65 0.37 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.517 1.927 . . . . 10.0 112.86 -176.36 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -79.64 57.05 2.37 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.724 1.21 . . . . 10.0 110.351 -177.296 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -112.15 123.0 49.31 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.154 1.382 . . . . 10.0 110.655 -171.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.4 t -93.57 133.31 37.01 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 173.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -32.37 -41.73 0.06 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.893 2.077 . . . . 10.0 113.326 171.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -40.61 -61.29 0.96 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.692 1.197 . . . . 10.0 113.7 170.19 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.12 -28.3 24.09 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.674 0.67 . . . . 10.0 111.383 178.102 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -43.7 78.31 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.948 -1.095 . . . . 10.0 111.244 176.771 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.7 ptmm? -72.49 -45.16 60.77 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.513 1.125 . . . . 10.0 109.698 178.076 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.504 ' HA ' ' HG2' ' A' ' 72' ' ' GLU . . . -50.25 -38.03 38.72 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 121.798 0.809 . . . . 10.0 111.889 173.476 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.29 -41.78 76.34 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.912 0.885 . . . . 10.0 111.851 -176.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 27.3 pt -76.24 -42.28 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 O-C-N 121.751 -0.593 . . . . 10.0 111.761 175.16 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLU . . . . . 0.504 ' HG2' ' HA ' ' A' ' 69' ' ' ALA 0.258 5.7 pt-20 -64.67 -25.09 67.8 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.659 -0.651 . . . . 10.0 111.905 177.827 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -49.33 -44.43 44.48 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.587 0.63 . . . . 10.0 112.112 164.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 70.0 mtm -82.0 -57.26 3.49 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.464 0.705 . . . . 10.0 110.332 178.798 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.1 t -177.65 121.21 0.11 Allowed 'General case' 0 C--O 1.223 -0.31 0 C-N-CA 126.822 2.049 . . . . 10.0 108.207 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.57 83.1 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.001 -1.062 . . . . 10.0 112.984 178.26 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.606 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -157.76 -69.58 0.09 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 114.055 1.131 . . . . 10.0 114.055 -178.167 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.429 ' HG2' ' CZ3' ' A' ' 31' ' ' TRP . 4.7 ptpp? . . . . . 0 C--O 1.249 1.072 0 C-N-CA 124.198 0.999 . . . . 10.0 112.103 -177.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.562 0 N-CA-C 113.134 0.79 . . . . 10.0 113.134 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -138.18 -172.46 3.28 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.35 2.26 . . . . 10.0 106.399 179.213 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.434 ' HB1' ' HA ' ' A' ' 70' ' ' ALA . . . -89.56 -45.65 9.23 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.653 2.381 . . . . 10.0 111.562 174.551 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -55.02 -50.09 69.9 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-O 121.931 0.872 . . . . 10.0 110.43 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.82 -31.44 69.33 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.464 -177.61 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -66.72 -52.06 49.45 Favored 'Isoleucine or valine' 0 C--N 1.34 0.18 0 N-CA-C 108.273 -1.01 . . . . 10.0 108.273 176.081 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -41.49 75.99 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 119.461 1.028 . . . . 10.0 110.328 -174.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -69.14 -23.97 64.03 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.464 1.106 . . . . 10.0 112.254 -178.413 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.7 ttpp -86.16 -30.48 22.45 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.18 -0.95 . . . . 10.0 113.423 166.819 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.38 -69.5 0.86 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.226 1.011 . . . . 10.0 112.84 -164.419 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.39 31.9 0.09 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.876 1.67 . . . . 10.0 111.234 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.9 t -111.38 8.71 21.38 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 124.624 1.17 . . . . 10.0 113.268 -164.183 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.7 t -111.42 -45.88 5.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.772 1.229 . . . . 10.0 108.902 -173.035 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.7 m -92.44 -64.24 1.13 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.946 1.699 . . . . 10.0 111.423 176.691 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -73.08 -25.65 60.97 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.425 0.69 . . . . 10.0 112.426 -166.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.03 -53.43 55.93 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.648 1.179 . . . . 10.0 111.014 -179.68 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.6 ttt -105.43 -21.03 13.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.283 1.033 . . . . 10.0 112.047 -178.118 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.95 53.48 2.37 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.111 0.862 . . . . 10.0 112.095 -175.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.8 t -95.05 162.66 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 125.131 1.372 . . . . 10.0 109.299 177.219 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 60.01 16.37 5.8 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.657 1.183 . . . . 10.0 113.976 -177.222 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.5 22.12 79.13 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 123.524 0.583 . . . . 10.0 113.028 -171.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.95 157.07 77.84 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 124.104 0.962 . . . . 10.0 112.07 177.242 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -72.79 165.27 33.23 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 122.577 2.185 . . . . 10.0 110.606 -178.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.9 tptt -77.37 126.42 30.88 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.652 -175.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.7 t -34.02 -42.69 0.13 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.391 2.276 . . . . 10.0 114.573 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.0 p-80 -138.59 133.51 32.6 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 108.459 -0.941 . . . . 10.0 108.459 157.209 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -148.59 168.43 22.79 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 125.565 1.546 . . . . 10.0 108.75 170.13 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.3 t -104.75 -36.83 7.29 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 120.567 -0.453 . . . . 10.0 111.438 164.459 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.57 -23.47 42.73 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 119.959 -1.713 . . . . 10.0 114.025 -174.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -82.68 -34.58 27.32 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.092 1.357 . . . . 10.0 109.33 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.45 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 45.9 m95 -85.82 -34.44 21.08 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 125.899 1.68 . . . . 10.0 111.907 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -43.63 -57.27 5.91 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 125.227 1.411 . . . . 10.0 114.43 174.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -65.25 -5.67 11.63 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.648 2.232 . . . . 10.0 113.898 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.442 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 8.8 mmt180 -103.05 -46.99 4.48 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.863 1.265 . . . . 10.0 110.369 179.038 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.2 mt -55.06 -4.3 0.07 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.883 1.673 . . . . 10.0 114.405 166.447 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.67 -33.31 17.62 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.087 1.355 . . . . 10.0 110.193 -176.691 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.53 -54.36 6.23 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 171.341 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 166.58 -132.89 2.75 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 110.916 -0.874 . . . . 10.0 110.916 -177.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 62.5 t -140.39 -56.92 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 124.181 0.992 . . . . 10.0 110.476 -173.214 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.42 ' HA ' HG12 ' A' ' 43' ' ' VAL . 62.2 m-20 -69.88 11.19 0.31 Allowed 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 113.701 1.0 . . . . 10.0 113.701 -176.695 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -92.68 -21.67 19.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 127.516 2.327 . . . . 10.0 111.143 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.4 -32.16 8.25 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.522 0.729 . . . . 10.0 110.874 -177.912 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' A' ' 40' ' ' ASP . 1.8 p -60.31 -23.79 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 125.68 1.592 . . . . 10.0 111.281 169.829 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.53 -44.66 57.08 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 121.363 -0.835 . . . . 10.0 111.875 167.189 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.598 ' HA ' HG22 ' A' ' 48' ' ' THR . 0.4 OUTLIER -76.05 -23.87 55.12 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 120.989 -1.069 . . . . 10.0 111.901 -174.319 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.426 HG13 ' CZ ' ' A' ' 67' ' ' TYR . 1.7 p -68.95 -40.64 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 O-C-N 121.027 -1.045 . . . . 10.0 111.129 172.773 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.64 -31.0 66.38 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.149 0.5 . . . . 10.0 111.372 -178.651 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' THR . . . . . 0.598 HG22 ' HA ' ' A' ' 45' ' ' SER . 1.5 t -89.43 -22.39 22.54 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.0 1.32 . . . . 10.0 112.495 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.05 117.56 0.82 Allowed Glycine 0 CA--C 1.535 1.307 0 N-CA-C 111.355 -0.698 . . . . 10.0 111.355 -170.154 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 tp -74.42 -152.48 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.992 0 O-C-N 122.031 -0.687 . . . . 10.0 110.393 169.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -65.27 -63.9 0.99 Allowed 'General case' 0 N--CA 1.471 0.618 0 O-C-N 119.753 -1.842 . . . . 10.0 111.592 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -101.39 44.19 1.02 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 113.282 -1.781 . . . . 10.0 109.084 -175.187 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -143.12 134.76 12.91 Favored Pre-proline 0 CA--C 1.536 0.42 0 C-N-CA 124.58 1.152 . . . . 10.0 111.606 -177.623 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.42 156.41 45.65 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 121.866 1.711 . . . . 10.0 110.211 176.106 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.67 120.52 7.64 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 122.759 2.306 . . . . 10.0 110.165 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.6 34.97 6.35 Favored Glycine 0 CA--C 1.531 1.087 0 O-C-N 122.091 -0.381 . . . . 10.0 113.242 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 57.18 -84.27 0.01 OUTLIER Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.556 1.074 . . . . 10.0 114.345 172.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -175.0 38.93 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.986 2.114 . . . . 10.0 112.376 165.322 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.45 147.77 49.08 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.751 1.221 . . . . 10.0 111.153 -175.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.8 t -71.42 -50.13 34.93 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -173.058 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -123.81 76.13 1.41 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.229 1.412 . . . . 10.0 108.473 175.36 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 8.3 m -71.87 91.1 1.15 Allowed 'General case' 0 CA--C 1.538 0.5 0 O-C-N 120.889 -1.132 . . . . 10.0 111.19 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -78.51 149.39 33.14 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 121.151 -0.968 . . . . 10.0 108.495 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.79 -37.32 76.07 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 120.315 1.416 . . . . 10.0 112.084 172.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.2 pt-20 -51.49 -46.6 63.22 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 119.065 -0.493 . . . . 10.0 111.608 174.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 -82.85 -39.43 21.64 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.829 0.74 . . . . 10.0 112.624 176.584 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CZ ' HG13 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -55.99 -46.22 78.78 Favored 'General case' 0 N--CA 1.463 0.22 0 O-C-N 120.5 -1.375 . . . . 10.0 111.543 -178.226 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -68.5 -45.79 71.39 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 -177.45 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.66 -38.97 61.37 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 121.633 0.73 . . . . 10.0 112.647 169.1 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.434 ' HA ' ' HB1' ' A' ' 3' ' ' ALA . . . -80.05 -39.55 29.56 Favored 'General case' 0 C--O 1.225 -0.226 0 O-C-N 120.602 -1.311 . . . . 10.0 113.592 -174.804 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.0 mt -70.38 -38.18 73.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 O-C-N 121.831 -0.543 . . . . 10.0 110.466 171.153 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . 0.299 0.0 OUTLIER -69.59 -31.71 70.02 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 114.195 1.183 . . . . 10.0 114.195 176.629 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -42.02 -47.14 4.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.628 1.171 . . . . 10.0 112.17 173.887 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.45 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.2 mpp? -81.65 -73.14 0.4 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.505 0.558 . . . . 10.0 112.505 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.2 33.87 0.17 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.155 0.582 . . . . 10.0 112.063 178.59 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.269 16.0 ptpt 42.62 46.81 4.4 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.892 1.677 . . . . 10.0 114.137 -179.297 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.442 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -150.97 -92.71 0.06 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.965 1.469 . . . . 10.0 114.965 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.4 pttt . . . . . 0 C--O 1.253 1.25 0 N-CA-C 116.071 1.878 . . . . 10.0 116.071 -175.666 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.533 0.327 0 N-CA-C 113.817 1.043 . . . . 10.0 113.817 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -139.69 -137.44 0.12 Allowed 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.365 1.066 . . . . 10.0 110.366 -172.162 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -147.94 -49.45 0.17 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 130.344 3.457 . . . . 10.0 109.302 -174.61 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -54.26 -50.51 67.07 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 121.247 0.546 . . . . 10.0 110.301 171.103 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 -29.75 68.69 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 121.777 -0.577 . . . . 10.0 111.415 -176.363 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.5 mp -68.8 -52.67 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.932 -1.136 . . . . 10.0 107.932 178.004 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.425 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -68.23 -41.25 81.53 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 118.225 -1.39 . . . . 10.0 110.918 -179.612 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -68.51 -22.95 64.5 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.132 1.373 . . . . 10.0 112.546 -176.779 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.72 -29.74 16.66 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.37 1.248 . . . . 10.0 114.37 166.298 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.27 -66.19 1.09 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.104 0.865 . . . . 10.0 112.363 -167.121 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.425 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.2 42.84 0.27 Allowed 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 124.126 0.971 . . . . 10.0 109.883 177.604 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.7 t -122.56 -6.88 8.64 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 120.477 -1.389 . . . . 10.0 114.03 -164.056 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.8 m -105.88 -41.97 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 123.59 0.756 . . . . 10.0 109.352 -178.219 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 m -86.88 -63.91 1.23 Allowed 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.657 1.583 . . . . 10.0 110.136 177.992 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -74.1 -28.23 61.26 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.277 1.214 . . . . 10.0 114.277 -167.954 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.1 t -59.58 -51.36 70.15 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.565 0.746 . . . . 10.0 111.408 -179.049 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 28.9 mmt -101.76 -19.49 15.33 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.434 0.694 . . . . 10.0 111.844 -179.531 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.18 49.59 4.17 Favored Glycine 0 CA--C 1.532 1.143 0 O-C-N 121.428 -0.795 . . . . 10.0 111.986 -178.222 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 66.6 t -99.29 162.95 2.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 126.127 1.771 . . . . 10.0 109.313 -177.816 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.68 19.66 8.34 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.411 1.084 . . . . 10.0 113.367 -176.237 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 81.23 10.29 84.94 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 124.522 1.058 . . . . 10.0 113.142 -174.941 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.96 144.49 95.77 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-N 118.422 1.111 . . . . 10.0 112.767 -176.863 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.446 ' CG ' ' HE3' ' A' ' 78' ' ' LYS . 42.6 Cg_endo -81.14 151.77 18.25 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 124.784 3.656 . . . . 10.0 110.392 179.349 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.2 mptt -103.25 143.2 32.96 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.211 -166.308 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.3 p -77.05 55.23 1.11 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.207 1.003 . . . . 10.0 112.46 175.131 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -146.96 -45.59 0.18 Allowed 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 114.072 1.138 . . . . 10.0 114.072 175.939 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -71.25 149.2 46.45 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 108.369 -0.974 . . . . 10.0 108.369 -177.925 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 9.5 t -95.46 -30.5 13.83 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 118.652 0.66 . . . . 10.0 110.139 178.111 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.42 -29.08 69.72 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 114.65 1.352 . . . . 10.0 114.65 -178.234 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -76.42 -31.39 57.88 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 122.34 1.067 . . . . 10.0 111.075 176.832 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 73.4 m95 -89.47 -32.02 17.41 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.32 1.448 . . . . 10.0 112.355 -177.038 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -49.18 -57.45 11.57 Favored Pre-proline 0 CA--C 1.542 0.667 0 O-C-N 120.461 -1.4 . . . . 10.0 114.609 175.509 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -65.72 -1.33 4.8 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 122.609 2.206 . . . . 10.0 113.209 178.617 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.5 mmt85 -101.14 -55.16 2.62 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.987 1.315 . . . . 10.0 108.513 176.806 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.519 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 1.0 OUTLIER -60.07 -13.73 13.15 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.725 1.61 . . . . 10.0 114.472 175.827 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -86.11 -38.84 17.34 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 124.363 1.065 . . . . 10.0 109.422 -174.135 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.49 -45.56 37.63 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.549 -0.75 . . . . 10.0 110.932 174.594 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 161.92 -136.32 4.32 Favored Glycine 0 CA--C 1.533 1.158 0 N-CA-C 110.822 -0.911 . . . . 10.0 110.822 -178.942 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 67.0 t -139.61 -57.53 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 122.524 1.154 . . . . 10.0 111.048 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -43.33 -36.78 1.99 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.281 1.832 . . . . 10.0 112.988 170.949 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -47.21 -27.32 1.45 Allowed 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.822 1.045 . . . . 10.0 113.822 173.883 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -100.45 -38.48 8.39 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 125.206 1.402 . . . . 10.0 111.471 179.535 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -53.26 -36.81 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 CA-C-N 118.912 0.778 . . . . 10.0 110.285 170.887 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.9 ptmt -63.72 -44.24 94.17 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.145 1.165 . . . . 10.0 114.145 171.446 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.7 m -64.46 -33.96 77.1 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 120.91 -1.119 . . . . 10.0 110.241 178.669 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.6 t -62.42 -55.0 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 123.736 0.814 . . . . 10.0 112.072 176.328 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.82 -36.97 65.56 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.762 0.315 . . . . 10.0 111.617 177.28 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 21.7 m -71.13 -34.67 71.26 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.945 0.898 . . . . 10.0 111.79 -177.802 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 75.4 112.32 0.1 Allowed Glycine 0 C--N 1.339 0.701 0 N-CA-C 110.596 -1.002 . . . . 10.0 110.596 -167.951 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.0 tp -68.9 -170.48 0.23 Allowed 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 121.501 0.667 . . . . 10.0 109.708 167.232 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -68.09 -61.01 2.05 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 119.559 -1.963 . . . . 10.0 112.023 -167.323 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.97 -40.85 83.07 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.789 1.236 . . . . 10.0 112.041 172.154 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.8 ttt -74.45 120.85 83.47 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 126.572 1.949 . . . . 10.0 112.594 -174.005 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -63.5 156.9 53.92 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.264 1.976 . . . . 10.0 111.712 -177.558 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -57.87 141.85 96.09 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 123.296 2.664 . . . . 10.0 110.475 178.143 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.23 22.01 72.42 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 120.177 -1.011 . . . . 10.0 113.451 -175.992 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.96 29.48 4.53 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 124.435 1.017 . . . . 10.0 114.462 -176.422 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.9 ttt 75.01 23.87 1.59 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.115 1.766 . . . . 10.0 114.382 -178.057 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.5 t -95.26 155.9 16.54 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 121.107 -0.995 . . . . 10.0 113.228 -179.086 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 41.4 m -69.75 -82.22 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.125 0.97 . . . . 10.0 112.552 178.627 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -125.49 43.12 3.13 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.421 1.088 . . . . 10.0 110.61 -176.711 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.27 126.96 29.74 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.224 -0.922 . . . . 10.0 111.658 -179.174 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.5 m -97.66 -83.49 0.4 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.544 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -156.08 -53.75 0.08 Allowed 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 127.278 2.231 . . . . 10.0 110.162 179.9 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -51.93 -42.53 62.87 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.08 0.552 . . . . 10.0 111.413 178.018 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -47.43 45.84 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 106.977 -1.49 . . . . 10.0 106.977 -178.045 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.24 -52.7 63.68 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.789 1.636 . . . . 10.0 111.798 -173.545 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -66.92 -42.31 85.58 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 125.055 1.342 . . . . 10.0 109.083 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.6 -35.46 63.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.448 1.022 . . . . 10.0 112.772 170.746 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.9 -47.01 49.49 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 120.293 -1.504 . . . . 10.0 111.099 177.841 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.1 mt -63.61 -37.61 80.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.982 1.313 . . . . 10.0 112.309 177.148 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -71.42 -30.33 65.94 Favored 'General case' 0 C--O 1.231 0.088 0 C-N-CA 124.606 1.162 . . . . 10.0 111.152 176.411 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -53.44 -30.09 38.76 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 112.927 0.714 . . . . 10.0 112.927 171.288 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 71.0 mtm -90.09 -72.72 0.55 Allowed 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.628 -0.67 . . . . 10.0 112.629 178.692 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.49 37.73 0.24 Allowed 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.765 -0.584 . . . . 10.0 112.497 176.24 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.7 ptmt 40.66 56.5 2.79 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 126.057 1.743 . . . . 10.0 114.665 172.489 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.519 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -159.72 -78.35 0.06 Allowed 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 124.371 1.068 . . . . 10.0 111.357 170.211 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.446 ' HE3' ' CG ' ' A' ' 23' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.242 0.666 0 N-CA-C 113.003 0.742 . . . . 10.0 113.003 -176.602 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 . . . . . 0 CA--C 1.53 0.181 0 N-CA-C 114.848 1.425 . . . . 10.0 114.848 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -156.52 120.49 4.37 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.613 0.721 . . . . 10.0 109.605 179.85 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -43.97 -39.14 3.87 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 114.741 1.386 . . . . 10.0 114.741 170.158 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -56.62 -47.95 78.53 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 121.874 -0.516 . . . . 10.0 110.51 172.365 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.23 -33.09 73.76 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.837 -0.539 . . . . 10.0 110.87 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 12.8 mm -65.17 -52.07 57.62 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 176.147 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.57 -41.78 79.23 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 118.144 -1.422 . . . . 10.0 111.438 -178.244 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -68.79 -22.64 64.26 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.08 1.352 . . . . 10.0 112.473 -176.756 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -94.42 -28.41 15.52 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.081 1.141 . . . . 10.0 114.081 168.676 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.23 -63.84 1.25 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.14 0.976 . . . . 10.0 113.005 -171.749 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.4 35.6 0.15 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.198 1.399 . . . . 10.0 111.04 -178.303 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.4 t -124.94 -1.57 7.81 Favored 'General case' 0 N--CA 1.46 0.054 0 C-N-CA 124.97 1.308 . . . . 10.0 113.779 -163.74 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.2 t -104.56 -47.83 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 124.783 1.233 . . . . 10.0 108.957 -173.016 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.5 m -84.33 -65.53 1.0 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.186 1.395 . . . . 10.0 110.717 172.05 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -74.4 -20.81 59.92 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.169 1.544 . . . . 10.0 115.169 -163.004 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m -64.73 -44.64 89.5 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 118.392 0.542 . . . . 10.0 110.979 176.845 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.8 mmt -102.17 -22.88 14.11 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.819 1.247 . . . . 10.0 111.899 -177.057 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.13 41.7 6.96 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.094 0.854 . . . . 10.0 111.931 -175.169 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 84.7 t -87.6 159.81 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 124.459 1.104 . . . . 10.0 109.417 179.076 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.63 16.17 5.21 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.938 1.295 . . . . 10.0 113.571 -174.342 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.92 16.18 80.24 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.212 0.91 . . . . 10.0 113.361 -172.803 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.78 132.79 94.0 Favored Pre-proline 0 CA--C 1.544 0.721 0 CA-C-N 118.649 1.224 . . . . 10.0 113.339 -174.55 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.11 140.85 61.25 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.788 2.992 . . . . 10.0 111.206 -178.589 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.36 145.21 55.97 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.809 0.814 . . . . 10.0 112.353 -166.712 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.9 p -51.34 -37.64 48.91 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.39 1.076 . . . . 10.0 113.275 176.455 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -122.19 40.88 3.54 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.398 1.258 . . . . 10.0 114.398 -174.598 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -85.03 165.35 17.61 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.425 -0.797 . . . . 10.0 112.099 174.103 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.2 t -104.34 -34.94 8.13 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.427 0.291 . . . . 10.0 111.415 165.663 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.43 -33.64 60.94 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 120.787 -1.195 . . . . 10.0 113.035 -174.689 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -73.15 -28.9 62.5 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.105 0.479 . . . . 10.0 110.366 179.305 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 69.7 m95 -91.67 -35.46 14.18 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.764 2.026 . . . . 10.0 110.938 -174.949 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -40.28 -63.17 0.76 Allowed Pre-proline 0 CA--C 1.547 0.832 0 N-CA-C 115.038 1.496 . . . . 10.0 115.038 174.173 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -66.19 -6.12 13.98 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.867 2.378 . . . . 10.0 113.497 -178.664 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.519 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 5.5 mmt85 -98.98 -45.63 5.89 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.977 1.711 . . . . 10.0 108.994 -177.916 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -24.39 63.51 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.818 2.047 . . . . 10.0 110.702 177.556 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.47 -28.53 52.36 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.366 1.066 . . . . 10.0 109.747 176.378 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt -77.38 -52.5 9.04 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.5 0.32 . . . . 10.0 110.519 172.654 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 164.63 -106.8 0.28 Allowed Glycine 0 CA--C 1.531 1.061 0 C-N-CA 123.558 0.599 . . . . 10.0 111.75 172.823 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -153.83 -61.58 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 C-N-CA 123.971 0.908 . . . . 10.0 109.413 177.405 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.482 ' HA ' HG12 ' A' ' 43' ' ' VAL . 1.3 m-20 -72.6 24.52 0.06 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.035 1.334 . . . . 10.0 113.242 -171.53 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.409 ' HB2' HD22 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -106.57 -25.64 11.73 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 127.705 2.402 . . . . 10.0 108.822 -176.767 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.409 HD22 ' HB2' ' A' ' 41' ' ' ASN . 3.5 mm? -99.52 -42.48 6.91 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.892 1.277 . . . . 10.0 110.85 178.948 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.482 HG12 ' HA ' ' A' ' 40' ' ' ASP . 2.7 p -53.25 -35.74 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 122.884 0.474 . . . . 10.0 111.069 171.985 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 ptmt -59.93 -43.6 94.85 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.717 -1.239 . . . . 10.0 112.419 171.767 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.7 m -72.46 -33.78 67.27 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.692 -0.63 . . . . 10.0 110.72 -176.765 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -47.57 85.62 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 O-C-N 122.067 -0.396 . . . . 10.0 111.197 172.617 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -30.8 71.11 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.788 0.328 . . . . 10.0 111.725 177.005 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.89 -35.95 64.72 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.535 0.939 . . . . 10.0 113.535 179.386 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.47 109.25 0.53 Allowed Glycine 0 CA--C 1.529 0.947 0 N-CA-C 111.254 -0.738 . . . . 10.0 111.254 -167.175 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.71 -154.79 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.139 0.975 . . . . 10.0 109.147 168.959 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -73.04 -66.53 0.66 Allowed 'General case' 0 N--CA 1.479 0.978 0 O-C-N 119.231 -2.168 . . . . 10.0 111.557 -174.875 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.35 -21.48 61.3 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.329 1.052 . . . . 10.0 111.801 174.396 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.4 mtm -84.87 125.2 71.44 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 112.525 0.565 . . . . 10.0 112.525 -179.668 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.51 150.09 69.27 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.063 1.842 . . . . 10.0 111.194 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -60.8 115.07 2.44 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 123.342 2.695 . . . . 10.0 109.817 179.669 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 95.5 10.78 56.56 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 121.309 -0.472 . . . . 10.0 113.559 -175.479 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.98 53.49 7.42 Favored Glycine 0 CA--C 1.536 1.391 0 CA-C-N 118.508 1.154 . . . . 10.0 113.233 175.156 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 83.02 -41.02 0.1 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 127.012 2.125 . . . . 10.0 112.588 -176.797 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.0 t -78.88 176.46 9.57 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.677 -0.64 . . . . 10.0 110.857 174.437 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.0 p -125.17 -73.59 0.63 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.912 1.285 . . . . 10.0 108.282 167.644 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -79.02 58.99 2.56 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.632 1.973 . . . . 10.0 110.439 -179.112 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 25.6 m -109.4 143.82 38.44 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.196 0.998 . . . . 10.0 112.729 169.949 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 98.8 m -125.83 151.09 47.28 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 125.389 1.476 . . . . 10.0 109.922 -178.781 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -39.59 -38.41 0.6 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.7 2.0 . . . . 10.0 114.82 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -35.33 -53.24 0.64 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.867 1.267 . . . . 10.0 114.349 168.362 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -99.63 -26.51 14.06 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.515 1.526 . . . . 10.0 113.274 171.841 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -50.38 40.9 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.391 -1.443 . . . . 10.0 110.665 -176.187 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.9 tttt -67.58 -50.71 57.04 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 123.794 0.838 . . . . 10.0 108.909 179.606 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.11 -26.08 2.51 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.512 0.93 . . . . 10.0 113.512 173.413 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.69 -39.38 20.24 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.893 1.277 . . . . 10.0 110.676 -179.839 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 71' ' ' ILE . . . . . 0.403 HG23 ' O ' ' A' ' 78' ' ' LYS . 3.5 mt -72.85 -45.99 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 125.456 1.502 . . . . 10.0 111.789 177.651 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.84 -26.61 67.74 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.434 1.094 . . . . 10.0 112.73 177.229 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -53.43 -28.54 30.57 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.399 0.889 . . . . 10.0 113.399 169.649 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 62.7 mtm -87.59 -78.05 0.32 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.69 0.796 . . . . 10.0 112.104 179.676 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.4 t -153.37 37.61 0.48 Allowed 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.823 -0.548 . . . . 10.0 111.588 176.255 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt 32.78 66.14 0.21 Allowed 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.532 1.933 . . . . 10.0 114.915 174.669 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.519 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -160.09 -53.86 0.06 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.419 0.896 . . . . 10.0 113.419 -176.959 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.403 ' O ' HG23 ' A' ' 71' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.604 0 C-N-CA 126.15 1.78 . . . . 10.0 111.344 -179.704 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 . . . . . 0 CA--C 1.534 0.337 0 N-CA-C 113.625 0.972 . . . . 10.0 113.625 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -142.98 128.78 19.37 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.112 -1.07 . . . . 10.0 108.112 171.754 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -52.87 -38.31 61.45 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.44 1.096 . . . . 10.0 112.983 172.128 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -56.61 -48.7 76.9 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.781 0.324 . . . . 10.0 110.275 170.206 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.91 -32.22 70.42 Favored 'General case' 0 CA--C 1.528 0.103 0 O-C-N 121.696 -0.627 . . . . 10.0 111.72 -177.611 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.434 ' CD1' ' HB3' ' A' ' 66' ' ' ASP . 36.0 mt -64.76 -52.96 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 N-CA-C 107.328 -1.36 . . . . 10.0 107.328 176.252 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.473 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -69.38 -42.52 75.06 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 117.934 -1.506 . . . . 10.0 111.457 -176.298 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -70.49 -24.03 62.78 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.689 1.595 . . . . 10.0 113.148 -176.618 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.14 -31.29 19.24 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.12 0.873 . . . . 10.0 111.984 167.604 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -102.4 -68.23 0.84 Allowed 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 114.094 1.146 . . . . 10.0 114.094 -171.773 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.473 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.82 41.12 0.34 Allowed 'General case' 0 CA--C 1.554 1.107 0 CA-C-O 123.176 1.465 . . . . 10.0 109.238 -174.922 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.0 t -123.99 -10.23 7.67 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 126.34 1.856 . . . . 10.0 112.701 -164.644 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 49.2 t -92.97 -51.62 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 C-N-CA 125.401 1.48 . . . . 10.0 108.102 -177.215 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.7 m -95.14 -57.12 2.51 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.701 1.601 . . . . 10.0 109.816 -171.771 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -73.15 -23.98 60.53 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.001 0.92 . . . . 10.0 112.914 -169.789 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.7 t -62.46 -40.43 96.61 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.799 0.809 . . . . 10.0 111.332 -173.802 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.3 tpt -118.77 -32.49 4.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.564 1.545 . . . . 10.0 112.337 -178.198 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.82 58.9 1.55 Allowed Glycine 0 CA--C 1.534 1.252 0 C-N-CA 124.704 1.145 . . . . 10.0 113.343 -176.687 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 96.0 t -82.35 -57.44 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 O-C-N 121.637 -0.92 . . . . 10.0 112.625 -176.581 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.05 31.22 0.38 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.035 0.934 . . . . 10.0 111.113 179.78 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 62.28 25.78 67.03 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 123.763 0.696 . . . . 10.0 112.552 -169.781 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.78 148.22 96.47 Favored Pre-proline 0 CA--C 1.54 0.578 0 O-C-N 122.015 -0.697 . . . . 10.0 111.467 177.079 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -77.62 142.4 20.51 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 123.287 2.658 . . . . 10.0 111.709 -171.15 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.39 130.18 30.58 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.347 1.24 . . . . 10.0 114.347 -172.295 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.0 m -17.33 -74.04 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 128.922 2.889 . . . . 10.0 115.627 -177.843 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -146.16 115.18 6.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 169.499 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -143.79 -175.74 4.7 Favored 'General case' 0 N--CA 1.443 -0.79 0 C-N-CA 124.325 1.05 . . . . 10.0 110.182 176.532 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 t -102.96 -30.0 11.06 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 170.014 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.47 -52.56 64.69 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 119.892 -1.755 . . . . 10.0 114.452 -173.98 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.429 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 9.5 t0 -77.8 -22.07 50.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.319 1.848 . . . . 10.0 110.049 -179.777 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.4 ' CE3' ' HB2' ' A' ' 75' ' ' SER . 54.3 m95 -86.74 -25.44 24.7 Favored 'General case' 0 CA--C 1.553 1.088 0 O-C-N 121.134 -0.979 . . . . 10.0 112.485 177.83 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -49.47 -56.91 13.75 Favored Pre-proline 0 CA--C 1.54 0.586 0 O-C-N 120.543 -1.348 . . . . 10.0 113.096 174.874 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -69.7 9.75 0.55 Allowed 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 122.457 2.104 . . . . 10.0 113.612 178.322 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -110.31 -49.97 3.01 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.477 1.511 . . . . 10.0 108.687 173.784 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 16.8 mt -63.43 9.01 0.06 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.51 1.924 . . . . 10.0 114.65 171.043 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -95.93 -29.16 14.32 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.406 1.482 . . . . 10.0 110.6 175.813 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.9 mmtt -92.47 -54.13 3.92 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.143 0.977 . . . . 10.0 109.968 179.844 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 166.72 -139.69 5.89 Favored Glycine 0 CA--C 1.533 1.167 0 N-CA-C 110.725 -0.95 . . . . 10.0 110.725 -178.543 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 60.5 t -132.75 -63.15 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.418 1.087 . . . . 10.0 109.545 -175.504 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.66 10.15 0.11 Allowed 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 125.98 1.712 . . . . 10.0 114.025 -176.447 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -90.63 -19.55 23.54 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 128.455 2.702 . . . . 10.0 111.48 176.743 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mt -106.48 -41.19 5.35 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.627 1.171 . . . . 10.0 109.028 -171.381 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.5 p -51.53 -37.0 18.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 C-N-CA 123.049 0.54 . . . . 10.0 111.556 168.227 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.3 ptmt -62.79 -39.22 93.56 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.022 -1.049 . . . . 10.0 113.285 171.929 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.9 m -70.3 -37.65 74.84 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 121.039 -1.038 . . . . 10.0 110.656 -179.67 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 14.2 t -52.88 -53.63 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 124.043 0.937 . . . . 10.0 110.395 172.209 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HA ' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -59.16 -35.75 74.09 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.774 0.657 . . . . 10.0 112.774 176.629 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 63.2 m -72.19 -33.3 67.55 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 118.9 -0.571 . . . . 10.0 112.319 -179.378 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.86 85.1 0.5 Allowed Glycine 0 CA--C 1.533 1.17 0 CA-C-N 119.413 1.006 . . . . 10.0 111.215 -174.019 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.44 172.38 0.34 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.655 1.182 . . . . 10.0 111.523 170.307 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -46.85 -57.79 4.57 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.802 -1.186 . . . . 10.0 112.992 -170.767 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -102.13 28.26 5.97 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 113.647 -1.615 . . . . 10.0 110.585 -179.644 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.3 mmm -123.07 129.2 25.05 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.912 1.285 . . . . 10.0 112.484 179.553 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -68.87 157.34 62.23 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.739 2.293 . . . . 10.0 110.825 176.098 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -61.85 132.81 41.52 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.508 2.139 . . . . 10.0 109.31 -178.679 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.412 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 53.45 41.12 63.0 Favored Glycine 0 C--N 1.338 0.673 0 C-N-CA 121.504 -0.379 . . . . 10.0 112.929 -178.185 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.47 50.58 10.34 Favored Glycine 0 CA--C 1.532 1.121 0 N-CA-C 112.062 -0.415 . . . . 10.0 112.062 -179.514 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 65.05 36.72 7.19 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.762 1.625 . . . . 10.0 112.808 176.592 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.5 t -126.18 148.74 49.37 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.293 1.037 . . . . 10.0 111.543 175.319 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 25.4 m -81.54 -75.03 0.3 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.259 0.623 . . . . 10.0 111.048 179.407 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -114.27 41.8 2.21 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.879 1.272 . . . . 10.0 111.631 -175.348 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 7.1 m -61.43 136.57 58.08 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.152 -0.968 . . . . 10.0 110.833 171.248 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 28.6 m -107.13 159.04 16.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.985 1.714 . . . . 10.0 108.881 175.775 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -44.26 -43.7 7.49 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.219 1.192 . . . . 10.0 114.219 175.865 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -51.56 -38.03 52.43 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.084 0.401 . . . . 10.0 112.084 176.595 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.434 ' HB3' ' CD1' ' A' ' 6' ' ' ILE . 0.3 OUTLIER -85.41 -48.15 9.28 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.922 0.889 . . . . 10.0 111.131 177.039 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.11 -52.44 65.73 Favored 'General case' 0 C--N 1.34 0.157 0 O-C-N 121.338 -0.851 . . . . 10.0 111.572 -175.725 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -61.13 -53.16 60.51 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 -179.563 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.29 -37.12 10.19 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.238 0.829 . . . . 10.0 113.238 170.628 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.34 -43.22 77.96 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.095 -1.003 . . . . 10.0 112.373 179.901 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 21.8 pt -76.23 -35.34 27.72 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 O-C-N 121.34 -0.85 . . . . 10.0 112.729 177.254 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -67.92 -29.31 68.36 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.535 1.534 . . . . 10.0 111.843 171.56 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -54.35 -50.54 67.2 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.95 -1.093 . . . . 10.0 110.861 169.696 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 70.1 mtm -65.77 -65.09 0.72 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.595 0.358 . . . . 10.0 110.071 178.047 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.4 ' HB2' ' CE3' ' A' ' 31' ' ' TRP . 3.8 m -141.66 -87.4 0.16 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.055 -0.35 . . . . 10.0 110.055 175.507 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt 174.34 49.27 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.131 1.772 . . . . 10.0 110.855 -176.598 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -168.4 -83.97 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.563 1.319 . . . . 10.0 114.563 179.58 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.429 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.151 0 N-CA-C 114.457 1.28 . . . . 10.0 114.457 -170.639 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.536 0.426 0 N-CA-C 115.137 1.532 . . . . 10.0 115.137 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -161.81 167.91 24.04 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.498 1.519 . . . . 10.0 107.27 -173.553 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.38 -49.02 13.02 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.645 2.378 . . . . 10.0 112.183 172.862 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -58.3 -45.92 87.07 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-O 121.126 0.488 . . . . 10.0 110.599 -179.398 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.29 -34.38 77.85 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.04 -0.412 . . . . 10.0 109.962 -176.68 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.473 HD12 ' SG ' ' A' ' 62' ' ' CYS . 4.8 mm -66.45 -50.56 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 118.388 -0.815 . . . . 10.0 110.779 177.009 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.1 -39.26 86.7 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 117.011 -1.876 . . . . 10.0 111.048 179.29 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -69.17 -22.45 63.91 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.482 1.513 . . . . 10.0 113.099 -178.107 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.61 -29.13 16.3 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.138 0.975 . . . . 10.0 113.175 170.758 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.22 -64.63 1.27 Allowed 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.136 0.974 . . . . 10.0 112.667 -169.286 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.01 42.05 0.24 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.893 1.277 . . . . 10.0 110.896 177.834 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.2 t -126.65 -2.5 6.69 Favored 'General case' 0 CA--C 1.521 -0.146 0 C-N-CA 124.948 1.299 . . . . 10.0 114.067 -163.968 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.8 t -102.78 -52.52 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 124.019 0.928 . . . . 10.0 108.861 -174.256 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.3 m -81.14 -64.91 1.09 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.728 1.611 . . . . 10.0 110.471 175.806 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 28.8 m-70 -73.65 -13.03 60.93 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.01 1.324 . . . . 10.0 114.534 -163.936 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 t -73.51 -38.92 65.18 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.161 0.584 . . . . 10.0 110.658 -179.101 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.8 tpt -117.87 -34.32 4.22 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.899 1.279 . . . . 10.0 113.001 -177.039 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.9 52.62 2.06 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.687 1.613 . . . . 10.0 113.414 178.806 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 84.4 t -75.02 -56.15 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 O-C-N 121.702 -0.881 . . . . 10.0 112.585 -174.452 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.91 33.72 0.44 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.74 0.816 . . . . 10.0 111.038 -179.299 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 65.04 21.35 67.81 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 124.406 1.003 . . . . 10.0 112.606 -170.809 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.65 140.59 97.5 Favored Pre-proline 0 CA--C 1.546 0.806 0 N-CA-C 113.426 0.899 . . . . 10.0 113.426 -172.559 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -71.56 143.4 42.38 Favored 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 125.217 3.945 . . . . 10.0 111.038 -177.255 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -67.19 145.14 55.54 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.258 -0.901 . . . . 10.0 113.43 -166.136 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 79.0 p -41.03 -40.09 1.36 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.714 1.206 . . . . 10.0 113.442 161.499 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -133.06 122.84 24.73 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.939 1.296 . . . . 10.0 110.511 171.706 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -154.69 170.46 21.5 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.867 2.067 . . . . 10.0 107.727 172.58 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.3 m -110.61 -37.99 5.3 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.644 0.656 . . . . 10.0 111.93 169.366 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.83 -19.72 37.03 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 120.996 -1.065 . . . . 10.0 112.836 -175.946 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -79.1 -35.51 42.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.455 1.902 . . . . 10.0 110.133 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.495 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 70.5 m95 -88.48 -37.87 15.44 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.802 2.441 . . . . 10.0 112.736 -179.695 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -40.01 -59.96 1.6 Allowed Pre-proline 0 CA--C 1.545 0.773 0 N-CA-C 113.983 1.105 . . . . 10.0 113.983 173.696 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.65 22.13 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.073 3.182 . . . . 10.0 114.731 178.895 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.624 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -125.98 -47.27 1.65 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.288 1.835 . . . . 10.0 109.854 167.7 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.46 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 1.5 mt -54.81 -5.45 0.09 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.316 1.846 . . . . 10.0 114.154 168.142 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.35 -31.41 48.56 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.194 1.398 . . . . 10.0 109.792 178.245 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.3 mttp -91.31 -57.18 2.87 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.79 0.436 . . . . 10.0 110.515 169.531 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.66 -114.52 0.66 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.255 -0.738 . . . . 10.0 111.255 172.643 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -127.04 175.74 8.45 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.085 0 C-N-CA 125.529 1.531 . . . . 10.0 110.612 176.904 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.9 t70 73.45 -42.15 0.51 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.37 1.468 . . . . 10.0 112.138 -174.381 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -20.22 8.34 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.262 -0.899 . . . . 10.0 113.192 -176.353 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -103.51 -40.65 6.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.676 1.59 . . . . 10.0 111.572 178.988 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.513 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.4 OUTLIER -48.27 -35.52 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 124.622 1.169 . . . . 10.0 111.819 167.449 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -66.81 -43.48 83.69 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 120.528 -1.358 . . . . 10.0 114.065 169.115 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.5 m -72.34 -34.12 67.8 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.643 -1.286 . . . . 10.0 111.522 -176.962 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.513 HG12 ' HA ' ' A' ' 43' ' ' VAL . 9.9 p -68.03 -47.16 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 O-C-N 121.612 -0.68 . . . . 10.0 110.967 174.268 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -56.07 -41.97 75.93 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.112 0.414 . . . . 10.0 110.822 -179.904 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 32.7 p -72.86 -35.1 67.14 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.115 0.783 . . . . 10.0 113.115 178.491 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.15 105.59 0.85 Allowed Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.868 0.758 . . . . 10.0 112.562 -174.743 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.87 170.38 4.32 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.151 0.981 . . . . 10.0 111.621 171.053 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -52.04 -60.36 3.28 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.583 -1.323 . . . . 10.0 113.419 -169.268 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.51 15.85 1.92 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.692 1.197 . . . . 10.0 112.635 174.167 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.9 ttp -125.39 129.72 24.35 Favored Pre-proline 0 CA--C 1.547 0.84 0 N-CA-C 113.834 1.05 . . . . 10.0 113.834 -175.128 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.16 156.75 53.42 Favored 'Trans proline' 0 CA--C 1.538 0.721 0 C-N-CA 121.492 1.461 . . . . 10.0 111.636 178.758 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -57.48 139.26 89.61 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 122.408 2.072 . . . . 10.0 109.143 177.835 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.32 23.23 59.8 Favored Glycine 0 CA--C 1.528 0.858 0 C-N-CA 121.162 -0.542 . . . . 10.0 114.025 -174.378 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 49.66 37.27 26.83 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.278 1.039 . . . . 10.0 111.266 -174.272 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER 91.55 -27.13 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.487 2.315 . . . . 10.0 112.871 -176.478 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 19.3 t -95.46 69.82 3.07 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.087 -1.008 . . . . 10.0 113.048 -176.864 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.4 m -53.82 -22.06 8.82 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.263 -0.898 . . . . 10.0 113.03 170.322 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -78.57 -24.36 45.6 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 127.005 2.122 . . . . 10.0 112.785 -178.677 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' CYS . . . . . 0.473 ' SG ' HD12 ' A' ' 6' ' ' ILE . 66.4 m -70.66 144.95 50.92 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.988 -1.07 . . . . 10.0 112.938 -173.536 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 91.3 m -100.54 -91.09 0.31 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.412 0.551 . . . . 10.0 110.526 -174.394 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -152.45 -50.03 0.11 Allowed 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 124.702 1.201 . . . . 10.0 109.57 179.154 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -52.96 -57.84 8.96 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.342 -0.849 . . . . 10.0 112.844 175.625 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -74.16 -28.61 61.39 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.443 1.02 . . . . 10.0 110.23 -179.021 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.28 -53.81 38.49 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.566 1.146 . . . . 10.0 111.206 -177.327 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.0 pttp -62.67 -49.73 73.97 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 107.362 -1.347 . . . . 10.0 107.362 179.426 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.95 -34.94 57.85 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.118 0.567 . . . . 10.0 112.247 175.811 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.51 -49.82 72.02 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.644 -0.66 . . . . 10.0 110.684 177.718 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 7.0 mt -67.65 -40.83 84.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.347 0.594 . . . . 10.0 111.768 176.572 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -57.83 -37.29 73.57 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.928 1.291 . . . . 10.0 111.435 172.804 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -54.26 -44.63 71.97 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.733 0.642 . . . . 10.0 112.733 176.796 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.495 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 1.2 mpp? -69.19 -74.05 0.14 Allowed 'General case' 0 CA--C 1.541 0.613 0 O-C-N 122.095 -0.378 . . . . 10.0 111.902 179.274 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 t -161.0 37.76 0.15 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.246 0.619 . . . . 10.0 112.3 178.496 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.255 2.5 ptpt 42.51 55.36 4.17 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.554 1.942 . . . . 10.0 114.741 174.613 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.624 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -158.86 -87.4 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.505 -0.77 . . . . 10.0 112.372 178.437 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.033 0 N-CA-C 115.687 1.736 . . . . 10.0 115.687 -163.512 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.53 0.211 0 N-CA-C 112.221 0.452 . . . . 10.0 112.221 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -147.03 112.69 5.66 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 124.028 0.931 . . . . 10.0 109.072 174.746 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -38.29 -41.64 0.63 Allowed 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.274 1.583 . . . . 10.0 115.274 166.155 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -58.04 -48.29 80.55 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.121 0.873 . . . . 10.0 110.404 171.399 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.22 -33.22 74.9 Favored 'General case' 0 N--CA 1.457 -0.122 0 O-C-N 121.795 -0.566 . . . . 10.0 110.37 -178.228 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 15.9 mm -65.84 -50.79 68.06 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-O 118.46 -0.781 . . . . 10.0 109.94 174.831 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.471 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -67.58 -40.39 84.83 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 117.379 -1.729 . . . . 10.0 111.15 -178.772 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -69.4 -22.68 63.68 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.971 1.708 . . . . 10.0 112.922 -178.704 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -92.69 -29.18 16.2 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.648 1.179 . . . . 10.0 113.206 170.663 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.92 -63.78 1.36 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.443 1.097 . . . . 10.0 112.734 -170.732 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.471 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.51 40.32 0.17 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.908 1.283 . . . . 10.0 111.131 178.962 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -127.6 1.57 6.17 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 114.254 1.205 . . . . 10.0 114.254 -164.158 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.7 t -96.75 -42.38 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 C-N-CA 124.918 1.287 . . . . 10.0 108.399 -179.139 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.2 m -105.33 -58.96 1.82 Allowed 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.666 1.986 . . . . 10.0 109.506 -169.428 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -74.26 -26.21 60.08 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.88 1.067 . . . . 10.0 113.88 -172.267 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.0 m -59.55 -47.86 83.9 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.415 0.686 . . . . 10.0 111.292 -177.961 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.6 tpt -106.83 -23.74 12.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.634 0.773 . . . . 10.0 111.932 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.04 57.99 1.63 Allowed Glycine 0 CA--C 1.535 1.323 0 C-N-CA 123.866 0.746 . . . . 10.0 112.234 -173.967 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 51.6 t -105.62 161.02 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 125.842 1.657 . . . . 10.0 109.518 -179.836 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 55.89 26.61 9.94 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.253 1.021 . . . . 10.0 112.693 -175.163 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.8 11.09 84.83 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.622 1.106 . . . . 10.0 113.944 -176.46 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.3 142.43 92.44 Favored Pre-proline 0 CA--C 1.548 0.87 0 CA-C-N 118.926 1.363 . . . . 10.0 113.761 -173.172 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -75.13 152.13 39.78 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 125.145 3.897 . . . . 10.0 110.529 -178.416 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.78 141.94 38.57 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -165.809 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.6 p -79.07 50.26 1.02 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.351 1.461 . . . . 10.0 113.43 -179.052 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -146.72 -39.71 0.21 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 115.623 1.712 . . . . 10.0 115.623 177.361 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.88 153.94 39.65 Favored 'General case' 0 C--O 1.226 -0.163 0 N-CA-C 108.211 -1.033 . . . . 10.0 108.211 179.289 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 34.1 m -96.13 -30.17 13.67 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 119.485 1.039 . . . . 10.0 110.267 174.251 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.39 -31.28 63.7 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.787 1.403 . . . . 10.0 114.787 -178.951 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -77.1 -31.41 55.84 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-O 121.792 0.806 . . . . 10.0 111.539 178.055 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.513 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 59.9 m95 -85.99 -33.6 21.04 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.119 2.167 . . . . 10.0 112.266 -178.265 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -46.94 -56.54 11.52 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.35 1.46 . . . . 10.0 113.424 175.5 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.35 14.97 0.21 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.321 2.681 . . . . 10.0 114.016 178.351 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.32 -52.65 2.48 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.014 1.726 . . . . 10.0 109.357 167.073 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.422 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -61.77 -19.2 62.22 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.642 1.577 . . . . 10.0 112.588 -179.204 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.13 -35.27 25.72 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 125.064 1.345 . . . . 10.0 109.601 -178.754 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -72.4 -50.36 27.0 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.175 171.12 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 162.68 -130.21 2.21 Favored Glycine 0 CA--C 1.533 1.177 0 N-CA-C 111.237 -0.745 . . . . 10.0 111.237 177.298 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.1 t -136.29 -58.84 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 123.753 0.821 . . . . 10.0 109.442 -178.01 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.67 11.08 0.06 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.607 1.963 . . . . 10.0 114.285 -177.701 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.43 -20.97 18.04 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 127.104 2.161 . . . . 10.0 110.837 178.577 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -100.26 -41.56 7.03 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.108 0.563 . . . . 10.0 111.352 -178.65 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -52.89 -35.71 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 CA-C-O 121.279 0.562 . . . . 10.0 111.188 172.564 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.3 ptmt -64.77 -43.75 92.25 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.954 1.094 . . . . 10.0 113.954 170.303 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.8 -36.7 81.87 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.017 -1.052 . . . . 10.0 109.78 177.128 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 23.0 t -60.1 -57.89 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.837 0 C-N-CA 123.067 0.547 . . . . 10.0 110.385 176.139 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -55.84 -34.53 65.5 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 112.885 0.698 . . . . 10.0 112.885 177.579 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.5 m -72.05 -35.94 69.47 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 176.014 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.61 109.74 0.54 Allowed Glycine 0 CA--C 1.536 1.384 0 CA-C-N 119.324 0.966 . . . . 10.0 112.16 -173.027 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.55 -174.45 3.39 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.304 1.042 . . . . 10.0 111.412 175.322 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -51.58 -55.37 19.55 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 123.317 1.532 . . . . 10.0 112.973 -167.165 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -113.14 34.2 4.62 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 111.575 -2.557 . . . . 10.0 108.915 -176.758 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 44.9 ttp -138.46 123.75 12.2 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 177.799 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -65.91 160.79 42.41 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 122.688 2.259 . . . . 10.0 111.963 -177.739 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -59.57 127.43 23.67 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.784 2.323 . . . . 10.0 109.891 -178.654 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.64 10.58 85.81 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 114.403 0.521 . . . . 10.0 114.403 -173.16 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 62.18 30.54 76.13 Favored Glycine 0 CA--C 1.54 1.624 0 CA-C-N 119.199 1.499 . . . . 10.0 112.697 -178.761 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 80.25 55.15 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.815 2.046 . . . . 10.0 111.549 176.137 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -127.69 167.24 16.72 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.907 1.683 . . . . 10.0 110.956 178.082 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.2 m -118.02 -89.28 0.59 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.861 0.864 . . . . 10.0 110.528 176.987 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -93.2 66.31 4.03 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.444 1.098 . . . . 10.0 109.148 -176.034 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 53.7 m -120.92 129.14 53.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.119 -0.946 . . . . 10.0 111.606 -170.744 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 81.2 m -125.64 145.77 50.01 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 123.666 0.786 . . . . 10.0 110.789 -172.597 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -32.75 -43.2 0.09 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 128.025 2.53 . . . . 10.0 113.932 176.71 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -28.58 -62.04 0.11 Allowed 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.839 2.056 . . . . 10.0 114.321 164.946 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.82 -28.19 12.58 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.489 1.116 . . . . 10.0 112.178 178.581 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -51.89 -41.58 62.05 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.826 -1.171 . . . . 10.0 112.085 170.753 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.424 ' HG3' ' N ' ' A' ' 69' ' ' ALA . 51.4 pttt -62.56 -55.7 24.78 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 107.744 -1.206 . . . . 10.0 107.744 175.681 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.424 ' N ' ' HG3' ' A' ' 68' ' ' LYS . . . -51.38 -33.22 29.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.809 0.844 . . . . 10.0 111.31 -179.71 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.37 -38.85 78.24 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 123.764 0.826 . . . . 10.0 111.749 -179.284 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 10.4 mt -79.4 -47.3 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.355 1.462 . . . . 10.0 111.036 174.937 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -48.25 -42.66 31.11 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 127.116 2.166 . . . . 10.0 112.049 171.428 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -44.41 -44.47 8.39 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.648 0.779 . . . . 10.0 112.185 175.882 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.499 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 3.2 mpp? -75.32 -70.7 0.41 Allowed 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.696 0.284 . . . . 10.0 111.435 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -161.71 32.59 0.13 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.155 0.798 . . . . 10.0 113.155 -178.923 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 39.42 55.36 2.3 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.088 1.355 . . . . 10.0 113.577 -179.098 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.444 ' HB3' ' HE3' ' A' ' 31' ' ' TRP . . . -140.08 -61.85 0.52 Allowed 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.532 -0.758 . . . . 10.0 112.372 178.78 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.513 ' HE3' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.731 0 N-CA-C 115.202 1.556 . . . . 10.0 115.202 -163.967 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 114.131 1.16 . . . . 10.0 114.131 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -156.61 159.87 38.88 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.529 1.532 . . . . 10.0 107.356 -174.95 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.51 -41.96 26.25 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 128.061 2.545 . . . . 10.0 112.082 179.116 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -57.14 -48.6 78.28 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 121.428 0.632 . . . . 10.0 109.702 175.011 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.91 -33.86 76.51 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.345 -175.63 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.0 mt -65.2 -52.22 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 CA-C-O 118.798 -0.62 . . . . 10.0 109.699 176.221 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.42 -38.12 80.92 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 117.142 -1.823 . . . . 10.0 111.313 -177.975 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -69.22 -22.48 63.87 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.69 1.596 . . . . 10.0 113.134 -179.438 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.94 -28.41 14.69 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.999 0.92 . . . . 10.0 113.241 170.631 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.1 -66.33 1.08 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.439 1.096 . . . . 10.0 112.474 -171.187 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.15 43.24 0.21 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 124.781 1.232 . . . . 10.0 111.127 178.12 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.8 t -129.24 -6.62 4.83 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 125.195 1.398 . . . . 10.0 113.816 -164.886 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.6 t -94.79 -43.98 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 124.052 0.941 . . . . 10.0 108.781 -175.245 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.0 m -104.43 -54.55 2.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 125.671 1.589 . . . . 10.0 109.257 -169.713 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -73.59 -13.41 61.01 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.351 1.46 . . . . 10.0 114.081 -172.896 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.3 t -73.01 -43.25 62.36 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.77 -0.581 . . . . 10.0 110.494 -178.144 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 16.3 tpp -112.18 -37.5 5.02 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.936 1.294 . . . . 10.0 112.999 179.917 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.98 58.98 1.27 Allowed Glycine 0 CA--C 1.534 1.268 0 C-N-CA 125.236 1.398 . . . . 10.0 113.461 -178.591 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 89.7 t -79.8 -60.28 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.615 -0.932 . . . . 10.0 112.711 -175.431 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.47 30.74 0.41 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.716 0.806 . . . . 10.0 111.171 178.884 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.57 6.69 81.72 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 124.348 0.975 . . . . 10.0 113.58 -173.466 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.43 135.83 69.97 Favored Pre-proline 0 CA--C 1.544 0.732 0 CA-C-N 118.07 0.935 . . . . 10.0 112.529 -176.272 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -69.36 149.83 69.93 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.917 3.078 . . . . 10.0 111.111 -175.335 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.63 134.48 39.3 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.156 0.583 . . . . 10.0 110.871 -163.985 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 94.8 p -39.7 -41.33 1.06 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.006 1.323 . . . . 10.0 114.1 178.142 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 26.6 p-80 -131.94 113.64 13.67 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.033 1.733 . . . . 10.0 109.701 173.094 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -149.53 162.19 40.64 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.927 1.691 . . . . 10.0 107.682 174.167 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 99.5 m -107.53 -37.08 6.29 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.596 0.635 . . . . 10.0 111.686 170.127 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.36 -24.94 39.45 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 121.188 -0.945 . . . . 10.0 112.629 -176.76 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -77.33 -39.0 49.19 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.699 1.6 . . . . 10.0 108.947 177.879 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.461 ' CH2' ' HG3' ' A' ' 78' ' ' LYS . 60.1 m95 -80.87 -34.83 33.39 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.21 1.804 . . . . 10.0 112.427 179.568 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -40.18 -61.1 1.23 Allowed Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 115.033 1.494 . . . . 10.0 115.033 172.798 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -68.42 -4.67 13.38 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.333 2.689 . . . . 10.0 113.897 -179.014 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.0 -47.97 6.74 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.124 0.97 . . . . 10.0 108.652 172.234 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.72 16.76 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.83 1.652 . . . . 10.0 115.277 171.699 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.01 -24.05 22.45 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 120.99 -1.069 . . . . 10.0 110.835 -178.071 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.7 mptt -101.16 -48.78 4.29 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.024 0.93 . . . . 10.0 109.868 173.632 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.5 -124.73 1.85 Allowed Glycine 0 CA--C 1.528 0.855 0 N-CA-C 110.412 -1.075 . . . . 10.0 110.412 172.928 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -117.41 175.48 3.25 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.132 0 C-N-CA 125.316 1.446 . . . . 10.0 110.581 175.601 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 70.79 -45.04 0.6 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.078 1.751 . . . . 10.0 112.035 -174.868 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -44.0 -37.59 3.05 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.503 1.047 . . . . 10.0 111.928 -177.424 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -81.03 -43.6 19.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 125.677 1.591 . . . . 10.0 112.227 -179.715 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.81 -31.7 47.97 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 CA-C-O 121.545 0.688 . . . . 10.0 110.09 175.68 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -60.64 -51.06 70.98 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.579 -0.701 . . . . 10.0 112.284 169.871 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 54.1 m -62.28 -35.8 80.13 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 121.128 -0.983 . . . . 10.0 110.296 178.322 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.6 t -61.77 -54.8 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 C-N-CA 123.246 0.618 . . . . 10.0 111.294 177.413 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.72 -36.28 67.06 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 111.928 0.344 . . . . 10.0 111.928 177.059 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 50.0 m -72.37 -40.9 66.95 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.29 0.636 . . . . 10.0 112.566 178.26 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.32 114.86 0.77 Allowed Glycine 0 CA--C 1.528 0.861 0 N-CA-C 111.048 -0.821 . . . . 10.0 111.048 -168.103 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.91 -163.68 0.11 Allowed 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.436 0.695 . . . . 10.0 110.374 169.199 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -71.06 -62.58 1.34 Allowed 'General case' 0 N--CA 1.471 0.584 0 O-C-N 119.839 -1.788 . . . . 10.0 111.353 -172.445 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.74 -14.93 60.34 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.894 1.278 . . . . 10.0 112.586 173.717 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.8 ttp -102.69 120.79 51.73 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 123.181 0.592 . . . . 10.0 112.134 -172.582 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.33 155.26 70.85 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.079 1.852 . . . . 10.0 112.128 -173.183 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -57.94 130.21 37.14 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.373 2.715 . . . . 10.0 110.461 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.53 29.83 75.44 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 118.458 -1.19 . . . . 10.0 113.968 -172.4 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.4 29.3 3.75 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-N 118.984 1.392 . . . . 10.0 115.688 168.703 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.1 ttt 62.5 35.41 14.64 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.271 1.828 . . . . 10.0 114.195 -173.5 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.7 t -123.91 70.02 1.07 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.763 2.025 . . . . 10.0 109.427 -178.28 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 72.7 p 11.55 -96.42 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 128.82 2.848 . . . . 10.0 115.675 -178.826 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -125.7 54.87 1.47 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.913 1.285 . . . . 10.0 109.475 173.541 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 84.1 m -69.67 134.99 49.33 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.337 -0.852 . . . . 10.0 112.503 -178.655 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.59 140.39 33.86 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.622 1.169 . . . . 10.0 110.069 -178.184 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -39.27 -37.11 0.39 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.666 1.986 . . . . 10.0 113.496 176.711 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -36.39 -59.74 0.62 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.549 1.54 . . . . 10.0 113.539 166.147 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -97.59 -25.43 15.14 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.581 0.752 . . . . 10.0 110.992 179.762 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -54.18 48.96 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 120.826 -1.171 . . . . 10.0 110.612 176.276 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -61.83 -40.63 95.97 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.967 0.907 . . . . 10.0 110.219 -176.426 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -57.89 -30.75 66.12 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.949 -0.47 . . . . 10.0 111.735 171.007 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.77 -40.25 33.74 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 120.781 -1.199 . . . . 10.0 110.526 -173.001 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -43.03 78.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 122.799 0.439 . . . . 10.0 111.055 172.801 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -30.96 71.84 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.524 -0.735 . . . . 10.0 111.636 179.286 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -51.05 -48.23 61.58 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.873 -0.517 . . . . 10.0 112.241 171.454 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -64.51 -47.24 79.64 Favored 'General case' 0 CA--C 1.532 0.26 0 O-C-N 121.734 -0.604 . . . . 10.0 111.496 174.073 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.9 t -164.28 -78.18 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 120.28 -0.568 . . . . 10.0 111.72 175.98 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.3 pttt 163.09 45.03 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.659 2.784 . . . . 10.0 109.501 -176.624 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -152.45 -81.05 0.1 Allowed 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 114.528 1.307 . . . . 10.0 114.528 166.617 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.461 ' HG3' ' CH2' ' A' ' 31' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.254 1.299 0 N-CA-C 117.347 2.351 . . . . 10.0 117.347 -165.816 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.1 0 N-CA-C 111.443 0.164 . . . . 10.0 111.443 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -143.62 115.11 8.08 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 123.666 0.786 . . . . 10.0 109.177 172.02 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.417 ' HB1' ' N ' ' A' ' 70' ' ' ALA . . . -43.87 -36.99 2.6 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.2 1.185 . . . . 10.0 114.2 167.997 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -54.49 -50.81 66.9 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 118.716 0.689 . . . . 10.0 110.468 170.533 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.74 -34.12 76.21 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 121.878 -0.513 . . . . 10.0 110.173 -175.638 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.2 mm -66.23 -51.05 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-O 118.041 -0.981 . . . . 10.0 110.113 176.42 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.405 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -67.59 -40.11 84.79 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 117.353 -1.739 . . . . 10.0 111.115 -179.916 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -69.07 -22.54 64.01 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.362 1.465 . . . . 10.0 112.637 -176.424 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -97.11 -26.66 14.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.443 1.097 . . . . 10.0 113.572 170.863 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -103.26 -68.35 0.84 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.954 1.302 . . . . 10.0 113.042 -175.599 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.405 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.65 41.99 0.28 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.469 1.508 . . . . 10.0 110.837 -178.476 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.4 t -126.76 -0.38 6.71 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 124.596 1.158 . . . . 10.0 113.52 -163.683 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 t -104.11 -53.14 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 C-N-CA 125.047 1.339 . . . . 10.0 108.573 -174.609 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.7 m -80.34 -65.8 0.96 Allowed 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.213 1.805 . . . . 10.0 110.192 176.333 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -72.91 -15.75 61.57 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.648 1.179 . . . . 10.0 113.983 -164.425 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.1 t -69.57 -41.24 76.09 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.827 -0.545 . . . . 10.0 110.829 -178.139 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.6 tpt -117.66 -35.76 3.86 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.889 1.276 . . . . 10.0 112.893 -177.468 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.89 56.46 1.31 Allowed Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.199 1.38 . . . . 10.0 113.693 179.927 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 64.0 t -78.49 -55.17 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 O-C-N 121.769 -0.842 . . . . 10.0 112.763 -176.046 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.05 32.83 0.44 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.739 0.815 . . . . 10.0 111.339 -179.076 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 62.0 32.21 81.37 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 123.926 0.774 . . . . 10.0 111.859 -169.914 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.65 148.23 82.39 Favored Pre-proline 0 CA--C 1.543 0.677 0 C-N-CA 123.656 0.782 . . . . 10.0 111.794 179.798 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -71.58 155.04 59.78 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 124.624 3.549 . . . . 10.0 110.481 -179.175 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -79.5 136.63 36.96 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.753 -0.592 . . . . 10.0 111.183 -172.525 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.7 m -37.13 -35.84 0.12 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.783 1.633 . . . . 10.0 114.67 169.742 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.4 p80 -131.81 117.44 18.55 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.374 1.07 . . . . 10.0 109.425 171.268 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.464 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . 3.2 m-20 -153.33 162.46 41.26 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 106.593 -1.632 . . . . 10.0 106.593 170.858 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 86.9 m -110.43 -36.35 5.8 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 118.21 0.459 . . . . 10.0 111.642 168.552 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.86 -25.24 37.81 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.289 -0.882 . . . . 10.0 113.046 -175.797 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 30' ' ' ASP . . . . . 0.464 ' HB3' ' HB3' ' A' ' 27' ' ' ASN . 65.1 t0 -79.18 -31.48 43.89 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.983 1.713 . . . . 10.0 109.383 176.057 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.49 ' CH2' ' HG3' ' A' ' 78' ' ' LYS . 56.7 m95 -84.02 -34.76 24.23 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.813 1.245 . . . . 10.0 111.285 179.481 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.85 -58.99 2.8 Favored Pre-proline 0 CA--C 1.551 0.984 0 N-CA-C 114.415 1.265 . . . . 10.0 114.415 173.451 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -73.72 6.79 2.64 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.33 2.687 . . . . 10.0 114.065 -178.784 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.74 -42.0 5.51 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.981 0.912 . . . . 10.0 108.67 169.659 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.89 22.1 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 115.159 1.54 . . . . 10.0 115.159 164.73 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.18 -36.96 14.49 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 120.955 -1.091 . . . . 10.0 110.023 178.768 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -76.35 -54.94 6.04 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.977 174.005 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 136.37 50.76 0.07 OUTLIER Glycine 0 CA--C 1.534 1.261 0 CA-C-O 119.334 -0.703 . . . . 10.0 114.808 168.483 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.9 t 62.03 165.36 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.861 1.264 . . . . 10.0 111.906 -179.67 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 77.41 -50.96 0.54 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.417 1.487 . . . . 10.0 110.738 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -38.23 -41.08 0.57 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.655 1.182 . . . . 10.0 111.942 172.091 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -68.37 -50.89 49.95 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 124.596 1.158 . . . . 10.0 111.293 -179.436 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.57 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.4 OUTLIER -50.45 -29.29 6.28 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 C-N-CA 124.321 1.049 . . . . 10.0 112.357 167.541 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.509 ' HE3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -81.67 -37.36 27.55 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 120.676 -1.265 . . . . 10.0 114.362 173.64 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.5 m -76.0 -16.9 59.89 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.451 1.1 . . . . 10.0 111.421 173.767 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.57 HG12 ' HA ' ' A' ' 43' ' ' VAL . 4.5 p -89.05 -41.23 13.82 Favored 'Isoleucine or valine' 0 C--N 1.34 0.167 0 O-C-N 121.666 -0.646 . . . . 10.0 111.801 175.119 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.411 ' HA ' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -53.11 -39.3 63.32 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.91 0.862 . . . . 10.0 110.942 177.315 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.5 t -73.34 -39.1 65.48 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.277 1.431 . . . . 10.0 112.243 178.256 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 82.5 99.84 0.47 Allowed Glycine 0 CA--C 1.532 1.124 0 C-N-CA 123.36 0.505 . . . . 10.0 111.99 -174.961 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.6 tp -58.56 168.88 1.03 Allowed 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.947 -0.737 . . . . 10.0 111.693 170.026 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -46.96 -57.96 4.45 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.531 1.532 . . . . 10.0 113.547 -174.336 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.69 14.77 7.87 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 114.367 -1.288 . . . . 10.0 112.538 177.138 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -110.96 153.51 43.78 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 114.795 1.406 . . . . 10.0 114.795 171.678 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -72.58 154.13 54.88 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.564 2.176 . . . . 10.0 110.737 169.327 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -62.09 132.41 39.09 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.641 2.227 . . . . 10.0 108.408 175.783 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.411 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 63.11 30.21 76.79 Favored Glycine 0 C--N 1.338 0.648 0 C-N-CA 118.946 -1.597 . . . . 10.0 112.357 179.697 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.57 32.28 2.8 Favored Glycine 0 CA--C 1.541 1.668 0 CA-C-N 118.076 0.938 . . . . 10.0 113.987 -179.121 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.1 ttt 70.19 44.42 0.76 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.019 1.728 . . . . 10.0 113.224 -176.438 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.07 156.32 40.17 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.99 1.316 . . . . 10.0 111.572 178.555 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 49.0 m -112.16 -91.97 0.48 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.275 1.03 . . . . 10.0 109.74 -179.257 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -89.8 66.53 7.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.875 1.27 . . . . 10.0 109.52 178.625 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 62.7 m -117.96 127.24 53.64 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.558 1.143 . . . . 10.0 111.429 -176.126 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 85.6 m -122.57 146.14 47.7 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.75 0.82 . . . . 10.0 109.927 -173.129 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -37.26 -42.45 0.46 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.983 2.113 . . . . 10.0 113.43 -178.406 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -35.87 -53.2 0.74 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.263 1.425 . . . . 10.0 113.905 172.296 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.56 -33.51 10.29 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.741 0.816 . . . . 10.0 111.655 173.823 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.04 -40.13 57.53 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.616 -1.302 . . . . 10.0 112.043 177.981 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.2 pttt -69.1 -48.25 63.09 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 123.387 0.675 . . . . 10.0 109.972 178.053 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.25 -32.34 62.25 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.374 0.534 . . . . 10.0 111.802 175.102 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.417 ' N ' ' HB1' ' A' ' 3' ' ' ALA . . . -67.54 -42.45 82.68 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.985 0.914 . . . . 10.0 109.934 -178.76 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -67.92 -51.83 45.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 125.999 1.72 . . . . 10.0 111.773 173.193 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -58.81 -32.7 69.6 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.236 1.415 . . . . 10.0 111.966 178.057 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -47.3 -50.46 21.59 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.275 0.488 . . . . 10.0 111.845 175.987 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.459 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.2 mpp? -66.73 -45.71 77.79 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.966 0.358 . . . . 10.0 111.966 179.002 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.2 t -162.59 -71.48 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.015 0.526 . . . . 10.0 111.567 176.712 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.2 pttt 160.43 50.11 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.38 2.672 . . . . 10.0 110.972 -175.097 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.1 -80.95 0.05 OUTLIER 'General case' 0 C--O 1.224 -0.282 0 O-C-N 121.271 -0.893 . . . . 10.0 113.043 171.711 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.49 ' HG3' ' CH2' ' A' ' 31' ' ' TRP . 6.4 ptpp? . . . . . 0 C--O 1.251 1.158 0 N-CA-C 114.832 1.419 . . . . 10.0 114.832 -178.584 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 . . . . . 0 CA--C 1.542 0.653 0 N-CA-C 114.313 1.227 . . . . 10.0 114.313 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 2' ' ' ASP . . . . . 0.425 ' C ' HD13 ' A' ' 6' ' ' ILE . 23.1 t70 -134.81 -129.49 0.16 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.591 1.556 . . . . 10.0 111.28 -167.518 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.7 -52.2 0.15 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 129.977 3.311 . . . . 10.0 109.112 -173.77 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -57.67 -49.28 77.02 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 121.441 0.639 . . . . 10.0 110.154 174.35 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.61 -30.9 70.61 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.902 -0.499 . . . . 10.0 110.775 -176.11 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.425 HD13 ' C ' ' A' ' 2' ' ' ASP . 1.7 mp -67.95 -51.5 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 N-CA-C 108.678 -0.86 . . . . 10.0 108.678 -179.835 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.36 -42.84 78.62 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 119.625 -0.83 . . . . 10.0 110.837 178.811 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -67.35 -22.4 65.59 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.002 1.321 . . . . 10.0 111.94 -176.13 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.77 -30.81 16.81 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.015 1.117 . . . . 10.0 114.015 167.303 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.03 -65.64 1.14 Allowed 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.893 1.224 . . . . 10.0 113.147 -171.094 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.28 43.83 0.31 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.146 1.378 . . . . 10.0 110.175 178.412 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.9 t -124.63 -3.25 7.82 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 125.076 1.35 . . . . 10.0 113.803 -166.254 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -103.2 -48.11 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 124.312 1.045 . . . . 10.0 108.554 -174.268 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.4 m -85.09 -66.28 0.91 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.748 1.619 . . . . 10.0 110.757 174.157 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -73.87 -19.37 60.74 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.824 1.416 . . . . 10.0 114.824 -163.22 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.2 t -64.79 -54.83 25.02 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.038 0.535 . . . . 10.0 111.035 175.543 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.7 tpt -97.0 -20.16 18.26 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.725 0.81 . . . . 10.0 112.747 -177.841 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.58 42.67 6.4 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 125.563 1.554 . . . . 10.0 112.3 -173.665 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 15.3 t -81.01 159.28 4.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 O-C-N 121.693 -0.886 . . . . 10.0 109.146 176.505 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.53 19.84 5.65 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.914 1.286 . . . . 10.0 113.37 -174.939 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.6 24.35 76.34 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 123.906 0.765 . . . . 10.0 113.127 -173.476 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.43 145.32 87.67 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 118.596 1.198 . . . . 10.0 113.533 -177.782 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -75.17 145.9 31.41 Favored 'Trans proline' 0 N--CA 1.454 -0.828 1 C-N-CA 125.512 4.142 . . . . 10.0 109.825 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -66.77 152.41 45.56 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-O 122.354 1.073 . . . . 10.0 112.137 -167.048 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.6 p -49.26 -33.18 12.27 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.721 1.608 . . . . 10.0 112.592 167.426 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -142.1 74.14 1.44 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.151 1.38 . . . . 10.0 111.947 -177.335 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 15.5 m-20 -103.41 166.27 10.53 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.767 1.227 . . . . 10.0 108.927 166.928 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.5 t -110.19 -36.03 5.94 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 166.979 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.87 -23.92 41.57 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.654 -1.279 . . . . 10.0 112.535 -176.86 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -79.21 -29.79 42.98 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.165 1.386 . . . . 10.0 110.509 178.455 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.465 ' HE3' ' HB3' ' A' ' 77' ' ' ALA . 57.7 m95 -89.64 -38.59 13.8 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.322 1.849 . . . . 10.0 111.091 -179.495 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -39.43 -61.97 0.9 Allowed Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 114.709 1.374 . . . . 10.0 114.709 174.961 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.04 -1.82 9.35 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.353 2.702 . . . . 10.0 113.862 -177.572 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 56.1 mmt-85 -98.9 -47.31 5.32 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.486 1.514 . . . . 10.0 108.695 176.665 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.15 -10.16 4.12 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 126.227 1.811 . . . . 10.0 113.656 172.762 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.81 -27.74 58.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.17 1.388 . . . . 10.0 109.503 178.179 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -92.96 -56.87 2.83 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.856 0.463 . . . . 10.0 110.51 169.412 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 165.47 -122.39 1.07 Allowed Glycine 0 CA--C 1.529 0.928 0 N-CA-C 111.567 -0.613 . . . . 10.0 111.567 179.864 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.3 p -151.4 -56.42 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 117.719 0.759 . . . . 10.0 111.352 -178.777 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.07 1.78 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.999 1.481 . . . . 10.0 114.999 171.748 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -69.7 -59.39 2.98 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.085 -1.009 . . . . 10.0 109.806 164.824 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.9 mp -80.09 -20.89 44.05 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.38 -0.825 . . . . 10.0 111.042 -166.436 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.437 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.4 OUTLIER -59.13 -15.68 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 124.285 1.034 . . . . 10.0 112.452 164.005 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -82.57 -35.21 27.36 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.086 -1.009 . . . . 10.0 111.819 168.15 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 7.8 t -69.69 -44.77 69.73 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 123.481 0.713 . . . . 10.0 110.277 177.663 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' VAL . . . . . 0.437 HG12 ' HA ' ' A' ' 43' ' ' VAL . 3.6 p -58.58 -41.61 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 123.24 0.616 . . . . 10.0 111.632 -179.148 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.407 ' NZ ' ' OD1' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -70.88 -28.51 64.61 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.966 -0.459 . . . . 10.0 111.781 179.505 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.3 m -76.23 -35.09 59.18 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.865 1.266 . . . . 10.0 112.507 172.656 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.72 105.05 0.3 Allowed Glycine 0 CA--C 1.525 0.684 0 C-N-CA 123.727 0.679 . . . . 10.0 111.873 -170.345 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.4 tp -68.07 174.51 3.77 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 122.095 -0.65 . . . . 10.0 110.252 170.338 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -49.57 -54.75 16.44 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.598 -1.314 . . . . 10.0 113.138 -172.67 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -88.78 16.02 7.44 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.398 1.479 . . . . 10.0 112.95 175.76 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -122.98 142.96 39.42 Favored Pre-proline 0 CA--C 1.545 0.784 0 N-CA-C 115.024 1.49 . . . . 10.0 115.024 175.955 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.64 139.92 41.86 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 121.885 1.723 . . . . 10.0 110.835 177.171 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -60.95 119.91 7.33 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.938 2.425 . . . . 10.0 109.582 177.187 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.402 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 86.93 12.65 68.08 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 119.625 -1.274 . . . . 10.0 112.643 -175.343 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 60.29 14.6 34.24 Favored Glycine 0 CA--C 1.54 1.614 0 CA-C-N 119.478 1.639 . . . . 10.0 114.579 171.415 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.4 ttt 41.82 45.62 3.18 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.445 2.298 . . . . 10.0 114.525 -175.357 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.8 p -115.56 24.86 11.23 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.628 1.171 . . . . 10.0 113.388 178.63 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.6 m 65.0 -127.97 0.35 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.699 0.8 . . . . 10.0 110.422 177.087 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -79.29 60.0 2.98 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.826 1.25 . . . . 10.0 110.999 -179.304 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 2.8 m -60.9 96.34 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.995 0.918 . . . . 10.0 112.076 -177.452 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.3 t -88.46 129.66 35.38 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 121.072 -1.017 . . . . 10.0 108.386 176.672 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.407 ' OD1' ' NZ ' ' A' ' 47' ' ' LYS . 5.8 m-20 -38.83 -38.5 0.43 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.979 1.712 . . . . 10.0 113.137 178.514 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -43.4 -59.44 2.13 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.264 1.425 . . . . 10.0 112.23 169.183 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -80.7 -37.4 30.73 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.965 0.888 . . . . 10.0 110.344 -179.231 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.6 -46.88 73.89 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.394 1.078 . . . . 10.0 111.161 -179.3 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.8 pttt -72.77 -47.61 45.25 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 124.386 1.074 . . . . 10.0 108.869 -179.639 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.63 -41.1 21.27 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.73 0.412 . . . . 10.0 111.791 173.727 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.76 -53.78 53.16 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.224 0.609 . . . . 10.0 111.237 179.758 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 31.7 pt -71.65 -31.5 42.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 O-C-N 120.961 -1.087 . . . . 10.0 112.84 179.579 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -58.24 -40.45 81.77 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.409 0.684 . . . . 10.0 111.352 167.478 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -51.82 -43.76 63.25 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.508 0.559 . . . . 10.0 112.508 177.165 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -70.37 0.27 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.909 0.337 . . . . 10.0 111.909 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.2 t -162.45 31.56 0.11 Allowed 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.833 0.679 . . . . 10.0 112.833 -178.973 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.4 ptpt 35.58 51.1 0.64 Allowed 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 115.624 1.713 . . . . 10.0 115.624 178.786 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.465 ' HB3' ' HE3' ' A' ' 31' ' ' TRP . . . -132.17 -49.82 0.94 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.629 0.974 . . . . 10.0 113.629 -176.092 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.7 pttp . . . . . 0 C--O 1.249 1.049 0 CA-C-O 116.606 -1.664 . . . . 10.0 112.08 -177.266 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 . . . . . 0 CA--C 1.531 0.244 0 N-CA-C 112.759 0.652 . . . . 10.0 112.759 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -152.0 114.58 4.58 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 121.951 0.882 . . . . 10.0 109.32 174.98 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.481 ' HB1' ' N ' ' A' ' 70' ' ' ALA . . . -56.25 -28.25 57.86 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 114.212 1.19 . . . . 10.0 114.212 174.31 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -56.24 -48.33 76.72 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 119.093 0.86 . . . . 10.0 110.426 166.812 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 -34.55 76.48 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.792 -0.568 . . . . 10.0 110.176 -178.019 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.2 mm -65.49 -51.17 66.8 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 CA-C-O 118.871 -0.585 . . . . 10.0 109.668 176.939 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.454 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -68.11 -41.1 82.29 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 118.176 -1.41 . . . . 10.0 111.014 -178.899 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -69.05 -22.28 64.04 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.363 1.465 . . . . 10.0 112.755 -178.06 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.45 -29.07 16.45 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.31 1.044 . . . . 10.0 113.554 168.559 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.3 -65.08 1.19 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.806 1.185 . . . . 10.0 112.952 -172.192 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.454 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -74.46 39.74 0.13 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.542 1.537 . . . . 10.0 111.322 178.655 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.7 t -126.71 3.34 6.74 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 125.084 1.353 . . . . 10.0 113.676 -165.16 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.3 t -100.91 -38.72 6.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 124.604 1.162 . . . . 10.0 108.685 -177.355 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.3 m -110.28 -58.73 2.03 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 126.263 1.825 . . . . 10.0 109.65 -170.275 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 26.3 m-70 -73.48 -25.7 60.58 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.289 0.848 . . . . 10.0 113.289 -173.394 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.18 -51.27 64.9 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.903 0.881 . . . . 10.0 110.499 -177.393 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -111.44 -23.29 10.84 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.771 1.228 . . . . 10.0 112.358 -177.878 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.83 59.96 1.16 Allowed Glycine 0 CA--C 1.537 1.44 0 C-N-CA 124.381 0.991 . . . . 10.0 112.518 -175.513 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 25.6 t -104.74 159.65 5.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 125.515 1.526 . . . . 10.0 109.638 178.237 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.54 23.08 10.41 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.441 1.096 . . . . 10.0 113.178 -176.08 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.24 10.06 86.46 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.304 0.954 . . . . 10.0 113.468 -174.441 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.51 149.62 98.26 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 118.622 1.211 . . . . 10.0 111.451 179.087 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -76.41 163.94 31.5 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 123.859 3.039 . . . . 10.0 110.09 -177.398 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -71.31 141.04 50.49 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.589 -0.694 . . . . 10.0 111.776 -178.087 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.7 t -35.63 -37.79 0.1 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 127.233 2.213 . . . . 10.0 114.327 171.444 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.4 p-80 -139.57 118.43 12.46 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 108.106 -1.072 . . . . 10.0 108.106 168.812 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -138.19 161.2 37.45 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.299 -1.371 . . . . 10.0 107.299 168.793 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.7 t -106.55 -33.24 7.74 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 117.514 0.143 . . . . 10.0 111.255 169.335 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.84 -36.1 70.07 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 120.412 -1.43 . . . . 10.0 113.485 -179.941 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -80.54 -21.87 41.39 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.033 0.533 . . . . 10.0 110.908 -178.314 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 62.9 m95 -93.87 -34.88 12.96 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.659 1.583 . . . . 10.0 109.945 -178.21 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -41.39 -63.02 0.89 Allowed Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 124.786 1.234 . . . . 10.0 114.296 175.003 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -73.24 5.42 3.15 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.86 2.373 . . . . 10.0 113.975 -178.224 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -106.37 -44.08 4.61 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.476 1.91 . . . . 10.0 109.463 174.081 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.25 12.21 0.47 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.755 2.022 . . . . 10.0 113.191 173.764 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.94 -27.69 28.35 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 125.124 1.369 . . . . 10.0 109.914 177.649 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -90.93 -56.78 3.05 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.142 0.577 . . . . 10.0 110.831 175.218 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 150.32 -124.78 1.81 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 110.949 -0.86 . . . . 10.0 110.949 175.748 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -126.23 177.55 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 125.528 1.531 . . . . 10.0 110.041 176.335 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.49 ' HA ' HG12 ' A' ' 43' ' ' VAL . 7.6 t70 73.8 -43.55 0.55 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.779 1.231 . . . . 10.0 111.614 -171.249 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.32 -48.7 65.28 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 120.691 -1.256 . . . . 10.0 112.537 -174.028 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.7 mt -88.54 -37.67 15.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.603 1.161 . . . . 10.0 111.011 -173.513 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.49 HG12 ' HA ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER -58.26 -29.19 36.96 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.426 0.631 . . . . 10.0 110.382 171.699 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.4 mtpt -63.86 -52.48 59.85 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 120.395 -1.441 . . . . 10.0 114.243 168.884 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.23 -33.12 70.62 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.155 -0.966 . . . . 10.0 109.872 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.54 -42.03 83.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 115.352 -0.84 . . . . 10.0 111.985 174.954 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.437 ' HA ' ' HA2' ' A' ' 56' ' ' GLY . 0.1 OUTLIER -81.82 -25.54 35.08 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.446 0.641 . . . . 10.0 111.71 -177.776 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 54.9 m -73.55 -32.98 64.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.944 0.897 . . . . 10.0 112.312 174.03 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 89.54 124.19 2.51 Favored Glycine 0 C--N 1.343 0.923 0 CA-C-N 119.755 1.161 . . . . 10.0 111.634 -174.194 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.43 -157.54 0.79 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.139 0.976 . . . . 10.0 111.91 176.155 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -68.03 138.48 55.88 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-O 122.524 1.154 . . . . 10.0 109.508 -179.311 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 56.29 18.86 3.58 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 111.516 -2.584 . . . . 10.0 112.003 176.459 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.0 ttp -136.89 121.64 12.64 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 123.993 0.917 . . . . 10.0 111.265 -171.733 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -68.36 143.89 59.84 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 121.602 1.535 . . . . 10.0 111.632 -174.971 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -62.16 113.95 2.11 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.43 2.753 . . . . 10.0 109.618 178.685 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.437 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 104.84 20.62 9.76 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 123.488 0.493 . . . . 10.0 112.75 -175.502 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 51.39 34.45 33.97 Favored Glycine 0 CA--C 1.54 1.605 0 CA-C-N 119.286 1.543 . . . . 10.0 114.116 177.434 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.0 ttt 65.16 23.12 12.31 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.15 1.78 . . . . 10.0 113.222 -176.554 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.3 t -121.91 155.61 35.1 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.725 1.21 . . . . 10.0 112.06 -170.732 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 80.2 m -88.49 -66.38 0.92 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.646 0.779 . . . . 10.0 111.139 179.736 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -124.46 63.78 1.1 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.403 1.081 . . . . 10.0 109.416 -177.747 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.0 m -81.54 118.89 23.12 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 121.686 -0.634 . . . . 10.0 110.45 172.01 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 62.2 m -108.28 135.44 49.6 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 108.345 -0.983 . . . . 10.0 108.345 179.707 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -32.38 -46.09 0.12 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.722 2.009 . . . . 10.0 114.477 -179.719 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -28.35 -60.85 0.12 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.682 1.993 . . . . 10.0 113.324 167.779 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.18 -37.14 12.26 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.937 0.895 . . . . 10.0 111.988 173.127 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.67 -39.07 50.03 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.985 -1.072 . . . . 10.0 112.311 -177.373 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.7 ptmt -75.51 -50.62 15.14 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.746 1.219 . . . . 10.0 109.361 178.671 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.87 -30.81 15.5 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.575 0.75 . . . . 10.0 111.955 179.174 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.481 ' N ' ' HB1' ' A' ' 3' ' ' ALA . . . -63.05 -44.85 94.69 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.546 0.738 . . . . 10.0 111.663 175.257 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 19.0 mt -73.18 -41.22 58.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 126.681 1.992 . . . . 10.0 111.086 177.425 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -63.83 -33.79 76.47 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.583 1.153 . . . . 10.0 111.862 174.836 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -55.13 -34.36 63.66 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 112.496 0.554 . . . . 10.0 112.496 171.282 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 65.6 mtm -86.43 -72.48 0.5 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.709 0.804 . . . . 10.0 112.229 -178.839 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -158.34 34.16 0.24 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.515 0.561 . . . . 10.0 112.515 178.064 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt 42.68 52.28 4.96 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.748 1.619 . . . . 10.0 113.86 172.237 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -158.94 -81.73 0.05 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.481 1.112 . . . . 10.0 112.656 173.233 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.229 0 N-CA-C 115.66 1.726 . . . . 10.0 115.66 -171.058 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.466 0.327 0 N-CA-C 113.468 0.914 . . . . 10.0 113.468 . . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -146.05 -175.79 4.9 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 105.437 -2.06 . . . . 10.0 105.437 177.04 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.545 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . . . -93.58 -44.32 8.26 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 126.215 1.806 . . . . 10.0 112.941 169.023 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -54.41 -37.74 65.42 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.528 0.68 . . . . 10.0 110.163 -177.451 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.94 -28.96 43.79 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.905 0.882 . . . . 10.0 113.087 174.802 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.28 -51.39 43.4 Favored 'Isoleucine or valine' 0 C--N 1.339 0.126 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 179.629 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -68.05 -29.46 68.44 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.363 -0.836 . . . . 10.0 111.035 -176.36 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.11 -23.29 65.82 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 126.072 1.749 . . . . 10.0 114.069 174.063 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 tppt? -100.66 -27.89 13.14 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.357 0.873 . . . . 10.0 113.357 172.174 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.99 -72.3 0.73 Allowed 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 124.988 1.315 . . . . 10.0 110.978 -167.068 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.74 37.3 0.14 Allowed 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.731 1.212 . . . . 10.0 110.667 179.043 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.0 t -120.53 -1.99 10.03 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.023 1.729 . . . . 10.0 114.041 -169.949 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 t -100.87 -39.89 7.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 122.362 1.077 . . . . 10.0 108.491 -174.275 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.0 m -101.09 -63.53 1.13 Allowed 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 128.003 2.521 . . . . 10.0 110.352 -177.709 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.4 m-70 -74.06 -29.15 61.75 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.483 1.29 . . . . 10.0 114.483 -168.693 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.1 m -54.8 -47.26 74.22 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.655 0.782 . . . . 10.0 110.881 178.59 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.4 ttt -116.26 -10.7 11.38 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.035 0.934 . . . . 10.0 112.526 -174.135 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.32 48.31 6.91 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 123.854 0.74 . . . . 10.0 112.85 -178.491 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 86.7 t -88.11 158.14 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 C-N-CA 125.438 1.495 . . . . 10.0 109.055 176.936 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.84 22.49 8.65 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.697 0.999 . . . . 10.0 113.697 -175.204 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.3 8.37 70.24 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 123.694 0.664 . . . . 10.0 113.332 -172.629 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.16 142.47 85.86 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 118.26 1.03 . . . . 10.0 111.713 -178.638 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' PRO . . . . . 0.448 ' HB2' ' HE2' ' A' ' 78' ' ' LYS . 83.4 Cg_endo -73.59 150.08 44.92 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.879 2.386 . . . . 10.0 111.092 -179.329 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.62 151.36 13.89 Favored 'General case' 0 C--O 1.245 0.851 0 CA-C-O 122.455 1.121 . . . . 10.0 112.482 -174.293 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.0 p -56.35 -34.35 66.53 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.104 2.562 . . . . 10.0 112.945 173.795 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -141.05 51.48 1.6 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.8 0.809 . . . . 10.0 112.41 177.275 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -69.64 161.62 29.31 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.133 -0.98 . . . . 10.0 109.948 170.592 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.4 t -107.86 -32.79 7.46 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.874 -0.516 . . . . 10.0 111.543 165.115 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.36 -24.78 39.57 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.42 -1.425 . . . . 10.0 113.587 -177.34 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.66 -18.98 39.12 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.745 1.618 . . . . 10.0 111.6 175.498 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -103.52 -34.19 8.76 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.744 1.618 . . . . 10.0 110.736 -176.853 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -43.29 -57.4 5.41 Favored Pre-proline 0 CA--C 1.545 0.786 0 CA-C-N 119.462 1.028 . . . . 10.0 113.637 170.991 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.12 3.53 3.94 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 122.187 1.925 . . . . 10.0 113.52 -179.308 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 34' ' ' ARG . . . . . 0.568 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 8.0 mmt85 -104.74 -47.89 3.93 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.765 1.626 . . . . 10.0 108.728 178.374 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.489 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -57.0 0.16 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.38 2.272 . . . . 10.0 114.246 168.122 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.69 -22.28 24.74 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.808 1.243 . . . . 10.0 110.484 175.678 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.9 mtmm -106.16 -63.45 1.26 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.565 0.746 . . . . 10.0 111.056 174.37 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 156.95 -165.31 33.12 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 111.363 -0.695 . . . . 10.0 111.363 -176.254 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -100.87 -41.77 9.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 124.329 1.052 . . . . 10.0 111.739 178.671 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.49 10.42 0.06 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.819 2.048 . . . . 10.0 114.694 -177.028 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -105.9 -58.06 1.96 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 126.192 1.797 . . . . 10.0 107.099 178.331 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.5 mt -72.46 -30.67 64.78 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.022 -0.99 . . . . 10.0 109.847 -174.392 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 p -60.99 -33.23 54.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-O 121.745 0.783 . . . . 10.0 110.879 171.863 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -69.73 -41.74 74.9 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.236 -0.915 . . . . 10.0 110.609 177.696 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.1 m -63.15 -36.0 82.16 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.458 -0.776 . . . . 10.0 110.317 174.294 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.5 t -60.52 -51.05 77.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 121.145 0.497 . . . . 10.0 111.647 179.375 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -33.61 72.39 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.078 0.466 . . . . 10.0 112.256 176.657 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.1 m -73.38 -33.07 64.84 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.822 0.849 . . . . 10.0 112.048 179.535 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.28 114.82 0.16 Allowed Glycine 0 CA--C 1.528 0.89 0 N-CA-C 111.195 -0.762 . . . . 10.0 111.195 -169.479 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.28 -157.33 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.145 0.978 . . . . 10.0 110.563 167.873 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -72.24 -63.35 1.16 Allowed 'General case' 0 N--CA 1.476 0.848 0 O-C-N 119.367 -2.083 . . . . 10.0 111.388 -175.167 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.72 -19.43 60.24 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.961 1.305 . . . . 10.0 111.742 176.608 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.1 ttp -97.43 120.35 61.03 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 123.405 0.682 . . . . 10.0 111.757 -173.216 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -69.42 155.69 66.35 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 121.715 1.61 . . . . 10.0 111.941 -173.273 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -63.95 117.82 4.8 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.997 2.465 . . . . 10.0 109.515 -177.564 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.08 30.48 9.32 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 120.997 -0.62 . . . . 10.0 112.78 -175.201 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 66.74 -63.53 0.18 Allowed Glycine 0 CA--C 1.534 1.252 0 C-N-CA 126.499 1.999 . . . . 10.0 114.665 174.161 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.8 ttp -171.84 -39.05 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.686 2.394 . . . . 10.0 110.685 171.82 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.51 -31.21 53.35 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 122.097 -0.377 . . . . 10.0 111.782 -178.604 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.8 m 72.76 -62.4 0.47 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.686 1.194 . . . . 10.0 112.592 -178.19 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -79.3 54.28 1.66 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.944 0.898 . . . . 10.0 110.579 -179.215 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.84 121.51 45.25 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.256 1.023 . . . . 10.0 109.718 -175.072 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 m -80.94 149.27 29.45 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.031 0.932 . . . . 10.0 110.53 -174.317 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -49.14 -40.21 31.76 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 120.121 1.328 . . . . 10.0 112.563 179.493 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -55.78 -38.8 70.39 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 113.521 0.934 . . . . 10.0 113.521 173.54 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -84.66 -38.27 20.01 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.876 1.27 . . . . 10.0 111.382 177.245 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -63.38 -55.1 27.21 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.376 -1.452 . . . . 10.0 111.426 178.157 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -48.99 74.43 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 107.573 -1.269 . . . . 10.0 107.573 -175.487 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.545 ' HB3' ' HB2' ' A' ' 3' ' ' ALA . . . -54.2 -31.52 53.21 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.367 0.506 . . . . 10.0 112.367 177.0 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.59 -50.14 53.94 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 119.206 0.912 . . . . 10.0 110.765 177.043 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 8.9 mt -60.54 -41.9 89.5 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.516 1.126 . . . . 10.0 111.701 176.232 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -65.41 -43.69 89.79 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.597 1.959 . . . . 10.0 112.374 175.138 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -55.61 -35.91 66.37 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.705 0.631 . . . . 10.0 112.705 174.501 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 56.2 mtm -76.61 -78.97 0.11 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.015 0.746 . . . . 10.0 113.015 179.787 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.4 t -151.62 37.06 0.58 Allowed 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.353 -0.842 . . . . 10.0 111.113 174.986 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 39.74 58.02 2.13 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.45 1.5 . . . . 10.0 113.5 172.923 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.568 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -155.02 -75.82 0.11 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.022 -0.99 . . . . 10.0 113.435 177.783 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.448 ' HE2' ' HB2' ' A' ' 23' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.245 0 C-N-CA 125.903 1.681 . . . . 10.0 112.978 -171.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.198 0 CA-C-O 119.228 -0.415 . . . . 10.0 110.641 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -159.83 125.86 4.26 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.404 1.082 . . . . 10.0 108.294 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' -1' ' ' LEU . . . . . 0.411 HD13 ' N ' ' A' ' -1' ' ' LEU . 0.0 OUTLIER -109.11 58.11 0.61 Allowed 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 126.087 1.755 . . . . 10.0 109.164 178.865 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -95.44 -20.09 19.35 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.075 -0.966 . . . . 10.0 110.548 177.361 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -145.02 122.8 11.89 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.987 -0.745 . . . . 10.0 108.987 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -53.86 -39.14 65.41 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.12 0.968 . . . . 10.0 112.573 172.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -58.67 -47.42 84.53 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 110.277 -0.268 . . . . 10.0 110.277 171.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.34 -31.78 72.28 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.426 -0.796 . . . . 10.0 110.688 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.5 mm -66.32 -50.98 63.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-O 118.442 -0.789 . . . . 10.0 110.145 176.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.18 -43.13 78.85 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 117.891 -1.524 . . . . 10.0 111.233 178.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.96 -22.57 64.11 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.376 1.47 . . . . 10.0 112.593 -175.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt -91.35 -31.57 16.02 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.408 -0.807 . . . . 10.0 113.178 168.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.48 -65.93 1.11 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.453 1.024 . . . . 10.0 112.506 -169.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.88 40.18 0.14 Allowed 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.088 1.355 . . . . 10.0 111.176 177.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.8 t -123.37 3.45 9.11 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 125.252 1.421 . . . . 10.0 113.779 -165.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 40.8 t -105.98 -46.83 8.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 124.234 1.013 . . . . 10.0 108.597 -174.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.6 m -91.01 -63.98 1.19 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 126.595 1.958 . . . . 10.0 111.471 177.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -73.32 -22.93 60.22 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.493 1.117 . . . . 10.0 113.977 -165.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.67 -53.74 54.82 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.157 0.983 . . . . 10.0 110.543 179.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 37.5 mmt -102.1 -23.8 14.02 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.402 1.081 . . . . 10.0 112.135 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.15 49.12 2.92 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 124.25 0.929 . . . . 10.0 112.04 -175.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 79.3 t -93.77 161.39 2.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.29 1.436 . . . . 10.0 109.397 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.07 18.9 6.76 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.456 1.102 . . . . 10.0 113.436 -174.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.3 18.43 76.23 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 124.566 1.079 . . . . 10.0 113.209 -173.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.56 145.53 90.19 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 118.525 1.162 . . . . 10.0 113.725 -172.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.88 137.21 17.47 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 125.047 3.832 . . . . 10.0 110.02 -177.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.24 139.69 58.8 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 123.95 0.9 . . . . 10.0 112.567 -163.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.5 p -51.31 -32.53 25.51 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.508 1.123 . . . . 10.0 113.249 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -134.2 115.34 14.06 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.694 1.197 . . . . 10.0 109.369 171.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -154.58 166.18 34.14 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 125.521 1.528 . . . . 10.0 108.425 176.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 56.5 m -110.13 -36.01 5.95 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 117.776 0.262 . . . . 10.0 111.637 168.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.49 -21.41 35.52 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.305 -0.872 . . . . 10.0 113.268 -176.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -78.67 -30.56 46.25 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.769 2.028 . . . . 10.0 109.528 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -92.67 -35.42 13.51 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 126.546 1.939 . . . . 10.0 111.849 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -43.18 -56.84 5.95 Favored Pre-proline 0 CA--C 1.549 0.94 0 N-CA-C 115.087 1.514 . . . . 10.0 115.087 175.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -67.95 -7.51 19.92 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.739 2.293 . . . . 10.0 113.413 -179.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -93.42 -51.62 4.89 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.684 1.194 . . . . 10.0 109.061 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.473 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.5 OUTLIER -61.77 8.78 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.868 1.667 . . . . 10.0 115.257 169.963 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.34 -37.92 14.53 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.977 0.911 . . . . 10.0 109.443 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -93.05 -38.72 11.48 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.01 0.924 . . . . 10.0 111.313 176.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 157.29 -143.56 9.69 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 111.325 -0.71 . . . . 10.0 111.325 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.9 t -127.04 -60.45 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 C-N-CA 123.734 0.814 . . . . 10.0 110.608 -176.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -44.96 -33.55 2.06 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.369 1.868 . . . . 10.0 113.653 176.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -48.34 -24.3 1.18 Allowed 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.101 1.36 . . . . 10.0 113.687 173.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -94.74 -47.04 6.65 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 125.431 1.492 . . . . 10.0 111.387 177.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.553 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.3 OUTLIER -51.96 -34.73 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 CA-C-N 119.434 1.015 . . . . 10.0 111.943 172.961 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -67.62 -44.01 79.03 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.525 -1.36 . . . . 10.0 112.627 169.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.5 m -64.08 -43.0 96.77 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.153 -0.967 . . . . 10.0 110.306 -177.028 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.553 HG12 ' HA ' ' A' ' 43' ' ' VAL . 7.6 p -65.64 -48.84 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 124.268 1.027 . . . . 10.0 111.634 178.429 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.59 -31.93 72.83 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.471 0.653 . . . . 10.0 110.828 176.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.3 m -74.04 -33.91 63.9 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.464 -0.772 . . . . 10.0 112.445 176.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 89.01 113.89 1.31 Allowed Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.587 -1.005 . . . . 10.0 110.587 -169.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.29 -170.03 0.9 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.985 0.514 . . . . 10.0 109.873 165.238 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -66.58 -57.02 8.11 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 119.904 -1.747 . . . . 10.0 111.745 -172.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.68 1.69 28.99 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 113.76 -1.564 . . . . 10.0 112.397 176.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 43.4 mtp -109.67 140.73 22.46 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 112.788 0.662 . . . . 10.0 112.788 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.9 149.19 65.68 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.65 1.567 . . . . 10.0 110.679 174.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -65.58 104.91 0.7 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.38 2.72 . . . . 10.0 110.155 -179.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 110.7 22.44 6.35 Favored Glycine 0 CA--C 1.525 0.7 0 CA-C-O 118.813 -0.993 . . . . 10.0 113.093 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 50.77 33.28 27.14 Favored Glycine 0 CA--C 1.535 1.286 0 CA-C-N 119.222 1.511 . . . . 10.0 114.477 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 6.0 ttm 60.2 29.87 19.37 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.866 1.667 . . . . 10.0 112.764 -176.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.6 -177.91 3.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.576 1.95 . . . . 10.0 110.171 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.5 t -145.99 -67.62 0.29 Allowed 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.582 -0.699 . . . . 10.0 110.72 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -105.41 31.22 5.08 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.671 1.188 . . . . 10.0 110.899 -176.113 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 64.8 m -88.92 114.07 25.15 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.768 1.227 . . . . 10.0 111.017 -172.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.4 p -86.3 151.18 23.8 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.433 0.693 . . . . 10.0 110.359 -174.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.79 -35.48 10.12 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 114.059 1.133 . . . . 10.0 114.059 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -49.28 -55.76 11.67 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.537 0.608 . . . . 10.0 111.348 171.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -76.29 -37.01 58.08 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.543 -0.723 . . . . 10.0 110.928 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -52.95 63.14 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 122.043 0.925 . . . . 10.0 111.115 -179.366 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.4 mmmm -64.87 -46.42 81.88 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 124.961 1.305 . . . . 10.0 108.96 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.94 -34.85 60.82 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 174.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.32 -43.5 70.16 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.644 -1.285 . . . . 10.0 111.279 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.23 -44.71 96.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 123.713 0.805 . . . . 10.0 112.051 169.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -76.1 -28.07 57.4 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.763 -1.211 . . . . 10.0 111.681 -175.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -46.87 -50.0 19.35 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.818 0.818 . . . . 10.0 110.716 170.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 72.2 mtm -68.46 -47.78 66.23 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.394 -0.821 . . . . 10.0 111.513 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 t -163.92 -87.41 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.353 0.661 . . . . 10.0 111.298 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt 172.43 53.15 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.825 2.05 . . . . 10.0 110.433 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.473 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -160.55 -85.27 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 114.025 1.12 . . . . 10.0 114.025 176.11 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.403 ' HA ' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.612 1.565 . . . . 10.0 115.072 -173.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.747 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.041 0 CA-C-O 118.452 -0.785 . . . . 10.0 110.117 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -163.2 126.79 2.81 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 123.847 0.717 . . . . 10.0 110.473 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -78.82 60.91 2.94 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.664 1.186 . . . . 10.0 109.984 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -111.95 -25.1 9.57 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 125.95 1.7 . . . . 10.0 112.621 173.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -148.91 116.66 6.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.667 0.746 . . . . 10.0 110.207 176.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.41 -33.06 19.44 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 113.139 0.792 . . . . 10.0 113.139 171.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -55.26 -50.61 69.03 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 118.29 0.496 . . . . 10.0 110.906 169.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.85 -34.21 75.08 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.296 0.638 . . . . 10.0 110.785 -177.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.2 mm -65.57 -51.84 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 118.47 -0.776 . . . . 10.0 109.381 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.403 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -68.35 -40.47 81.52 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 120.211 1.369 . . . . 10.0 111.249 -178.465 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -68.68 -22.25 64.38 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.461 1.504 . . . . 10.0 112.615 -178.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.49 -29.54 16.94 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.038 -1.039 . . . . 10.0 113.502 167.294 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -106.62 -66.34 1.02 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.742 1.217 . . . . 10.0 112.442 -168.728 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.403 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -78.67 41.1 0.4 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.962 1.705 . . . . 10.0 109.771 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.8 t -123.21 4.09 9.21 Favored 'General case' 0 N--CA 1.461 0.084 0 C-N-CA 124.485 1.114 . . . . 10.0 112.997 -166.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.7 t -107.0 -53.68 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 C-N-CA 125.097 1.359 . . . . 10.0 108.676 -173.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.6 m -81.43 -62.18 1.73 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.609 1.163 . . . . 10.0 111.629 174.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -73.59 -19.34 60.9 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.967 1.307 . . . . 10.0 114.097 -164.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 t -64.92 -46.5 81.4 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.731 0.812 . . . . 10.0 111.032 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.8 mmt -104.56 -27.28 11.97 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.277 1.431 . . . . 10.0 111.88 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.38 52.8 1.8 Allowed Glycine 0 CA--C 1.533 1.174 0 C-N-CA 124.845 1.212 . . . . 10.0 112.156 -176.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 40.9 t -96.11 161.33 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.75 1.22 . . . . 10.0 109.786 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.23 16.89 5.25 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.083 1.353 . . . . 10.0 113.755 -176.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 74.95 25.52 69.05 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 123.858 0.742 . . . . 10.0 112.843 -172.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.25 141.56 91.53 Favored Pre-proline 0 CA--C 1.537 0.468 0 CA-C-N 118.384 1.092 . . . . 10.0 112.846 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -68.66 145.24 62.97 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 124.08 3.186 . . . . 10.0 110.754 177.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.6 mtpt -73.75 143.39 46.11 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.116 0.413 . . . . 10.0 112.116 -168.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.9 p -57.37 -26.03 60.39 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.119 0.968 . . . . 10.0 113.222 175.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -132.91 105.73 7.28 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.139 0.976 . . . . 10.0 109.338 171.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -147.09 157.98 43.79 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 106.898 -1.519 . . . . 10.0 106.898 173.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.1 t -104.31 -36.09 7.73 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.03 0.377 . . . . 10.0 110.876 166.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.03 -19.19 52.09 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.313 -1.492 . . . . 10.0 113.97 -176.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -89.75 -23.0 21.9 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.654 1.582 . . . . 10.0 110.398 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.596 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 49.4 m95 -97.82 -32.51 11.67 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.834 1.254 . . . . 10.0 110.591 178.215 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -44.14 -58.17 5.25 Favored Pre-proline 0 CA--C 1.542 0.646 0 N-CA-C 114.615 1.339 . . . . 10.0 114.615 172.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.47 6.85 2.1 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.685 2.257 . . . . 10.0 113.612 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -110.8 -42.51 4.0 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.866 1.666 . . . . 10.0 108.777 178.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.18 2.18 1.26 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.465 1.906 . . . . 10.0 114.232 170.071 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.0 14.57 28.7 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.539 1.136 . . . . 10.0 110.61 177.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 24.9 mmtt -125.42 -61.96 1.24 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.104 1.362 . . . . 10.0 110.606 173.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 172.09 -125.44 1.18 Allowed Glycine 0 CA--C 1.53 0.994 0 N-CA-C 110.321 -1.111 . . . . 10.0 110.321 -177.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.81 -55.74 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.299 0 C-N-CA 123.992 0.917 . . . . 10.0 110.6 -179.103 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.13 26.62 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.303 1.441 . . . . 10.0 113.995 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -102.78 -49.21 3.87 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.318 1.847 . . . . 10.0 107.208 177.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.6 mp -80.18 -35.05 36.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.634 -172.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.534 ' HA ' HG12 ' A' ' 46' ' ' VAL . 2.1 p -59.06 -23.76 25.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 124.841 1.257 . . . . 10.0 112.362 171.113 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -78.88 -44.89 21.84 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.359 -0.838 . . . . 10.0 111.321 171.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.22 -42.05 99.21 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.47 -0.769 . . . . 10.0 110.285 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.534 HG12 ' HA ' ' A' ' 43' ' ' VAL . 9.0 p -64.33 -48.2 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 122.901 0.48 . . . . 10.0 110.845 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -33.96 76.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.981 0.42 . . . . 10.0 110.325 177.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.0 m -73.41 -28.94 62.27 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.867 0.691 . . . . 10.0 112.867 175.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.79 119.43 1.42 Allowed Glycine 0 CA--C 1.529 0.918 0 CA-C-N 119.271 0.941 . . . . 10.0 111.126 -172.412 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.8 tp -78.49 -146.09 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 123.918 0.887 . . . . 10.0 110.241 171.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -82.11 -64.06 1.26 Allowed 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.003 -1.686 . . . . 10.0 111.048 -175.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.84 -7.86 56.26 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.677 1.191 . . . . 10.0 112.521 174.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.5 mtp -97.05 135.34 22.02 Favored Pre-proline 0 CA--C 1.538 0.501 0 N-CA-C 113.073 0.768 . . . . 10.0 113.073 178.556 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.03 157.09 55.16 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.189 1.926 . . . . 10.0 110.635 175.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.54 101.83 0.46 Allowed 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.233 2.622 . . . . 10.0 109.989 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 118.7 -0.15 15.51 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 123.681 0.658 . . . . 10.0 112.909 -172.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.409 ' O ' HMC2 ' A' ' 90' ' ' HEC . . . 75.71 -48.51 2.29 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 118.78 1.29 . . . . 10.0 112.667 -179.092 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -174.44 -37.21 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.995 2.118 . . . . 10.0 111.366 166.383 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -79.25 177.44 8.83 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.947 0.721 . . . . 10.0 112.947 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 t -128.1 -60.67 1.13 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.998 1.319 . . . . 10.0 111.215 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.35 54.01 1.92 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.586 1.154 . . . . 10.0 111.393 -177.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 18.8 m -110.03 125.72 53.22 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.452 1.501 . . . . 10.0 111.372 -177.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 30.2 m -112.89 137.13 51.72 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.86 1.264 . . . . 10.0 109.776 -177.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -35.31 -46.18 0.35 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.775 2.03 . . . . 10.0 114.055 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -28.92 -64.29 0.1 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.341 1.856 . . . . 10.0 112.733 165.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -90.17 -34.19 15.94 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.284 0.633 . . . . 10.0 111.724 177.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.58 -44.69 56.91 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 120.707 -1.246 . . . . 10.0 112.487 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.16 -48.17 53.37 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.639 0.776 . . . . 10.0 110.6 174.313 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.2 -30.6 7.19 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.473 0.545 . . . . 10.0 112.473 172.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.97 -34.36 57.58 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.539 1.136 . . . . 10.0 111.53 -178.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.423 HD11 HMB2 ' A' ' 90' ' ' HEC . 0.3 OUTLIER -75.0 -52.87 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.519 1.128 . . . . 10.0 110.115 175.227 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -64.87 -25.71 68.01 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.513 0.725 . . . . 10.0 112.665 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -40.45 -48.08 2.71 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 121.75 0.786 . . . . 10.0 112.085 169.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.8 mpp? -74.68 -49.34 21.66 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.489 -0.778 . . . . 10.0 112.539 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.452 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 5.5 t -152.72 -89.91 0.05 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.787 -0.625 . . . . 10.0 110.208 175.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 169.17 54.96 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.812 1.645 . . . . 10.0 110.001 -176.039 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -167.22 -87.72 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.328 1.051 . . . . 10.0 113.08 173.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.596 ' HE3' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.285 -0.864 . . . . 10.0 112.414 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.735 HMC1 ' CBC' ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.271 0 N-CA-C 114.394 1.257 . . . . 10.0 114.394 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -164.06 82.68 0.43 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.255 0.934 . . . . 10.0 111.46 -173.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' -1' ' ' LEU . . . . . 0.455 HD22 ' O ' ' A' ' -1' ' ' LEU . 0.0 OUTLIER -77.18 36.11 0.18 Allowed 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.274 1.213 . . . . 10.0 114.274 -176.338 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -99.46 -26.41 14.13 Favored 'General case' 0 C--N 1.333 -0.127 0 O-C-N 121.676 -0.64 . . . . 10.0 112.028 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -139.66 120.36 14.29 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 121.533 0.683 . . . . 10.0 109.463 171.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.24 -36.32 30.6 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.723 0.809 . . . . 10.0 113.089 171.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -59.64 -45.67 91.31 Favored 'General case' 0 C--N 1.343 0.309 0 O-C-N 121.972 -0.455 . . . . 10.0 110.622 171.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.05 -31.97 72.0 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.53 -0.731 . . . . 10.0 111.05 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.2 mm -65.32 -51.78 60.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 O-C-N 121.397 -0.814 . . . . 10.0 108.904 175.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.459 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.15 -42.28 76.18 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 117.87 -1.532 . . . . 10.0 111.905 -178.896 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.83 -22.0 64.26 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.466 1.506 . . . . 10.0 112.443 -177.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -92.04 -29.1 16.76 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.829 1.048 . . . . 10.0 113.829 168.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.91 -64.93 1.22 Allowed 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.218 1.007 . . . . 10.0 112.394 -170.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.459 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.56 40.63 0.18 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.222 1.409 . . . . 10.0 111.232 178.429 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.4 t -126.9 -4.09 6.4 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 124.805 1.242 . . . . 10.0 114.101 -165.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.4 t -97.29 -40.58 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-O 122.456 1.122 . . . . 10.0 108.426 -175.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.3 m -104.06 -61.09 1.48 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 126.765 2.026 . . . . 10.0 109.631 -173.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -74.27 -16.7 60.94 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.537 1.31 . . . . 10.0 114.537 -169.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.0 m -69.81 -44.91 69.05 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.692 0.797 . . . . 10.0 110.893 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 tpt -115.05 -30.66 6.29 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.318 1.047 . . . . 10.0 113.039 -175.433 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.38 61.4 1.81 Allowed Glycine 0 CA--C 1.535 1.342 0 C-N-CA 125.533 1.539 . . . . 10.0 113.183 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 67.2 t -81.8 -57.13 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.951 -0.735 . . . . 10.0 112.056 -175.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.75 35.4 0.51 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.066 0.947 . . . . 10.0 110.725 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 58.64 27.35 61.24 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 124.686 1.136 . . . . 10.0 113.094 -173.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.52 138.19 96.77 Favored Pre-proline 0 CA--C 1.547 0.863 0 O-C-N 122.042 -0.681 . . . . 10.0 111.943 -177.024 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -68.67 149.7 73.81 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 123.35 2.7 . . . . 10.0 111.025 -174.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -70.29 137.6 50.84 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.212 -0.93 . . . . 10.0 112.374 -161.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.4 m -51.53 -25.48 6.74 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.263 1.209 . . . . 10.0 114.263 172.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 -142.5 91.14 2.29 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.637 0.775 . . . . 10.0 110.632 174.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -128.07 171.15 12.14 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.64 1.176 . . . . 10.0 109.166 170.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.6 m -105.36 -33.28 8.23 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 119.37 -0.348 . . . . 10.0 110.925 163.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.91 -38.66 61.77 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.904 -1.122 . . . . 10.0 113.852 -176.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -66.79 -31.02 71.38 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.744 0.783 . . . . 10.0 110.072 177.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.458 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 64.4 m95 -91.79 -34.42 14.59 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.33 2.252 . . . . 10.0 111.982 -171.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -41.16 -61.98 1.17 Allowed Pre-proline 0 CA--C 1.546 0.816 0 N-CA-C 114.094 1.146 . . . . 10.0 114.094 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -71.26 8.79 1.02 Allowed 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 123.08 2.52 . . . . 10.0 114.006 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -113.36 -51.45 2.81 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.019 1.728 . . . . 10.0 108.448 -178.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -21.8 66.65 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.601 1.96 . . . . 10.0 112.053 173.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -79.64 -27.96 40.9 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.153 0.981 . . . . 10.0 110.057 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -76.41 -54.45 6.72 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.226 0.61 . . . . 10.0 109.936 174.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 162.5 -113.61 0.57 Allowed Glycine 0 CA--C 1.53 0.997 0 N-CA-C 111.167 -0.773 . . . . 10.0 111.167 176.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -144.09 -57.97 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.31 0 C-N-CA 124.201 1.0 . . . . 10.0 110.572 176.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.89 6.73 0.15 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.007 1.723 . . . . 10.0 113.537 -174.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -93.34 -17.87 23.07 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 125.467 1.507 . . . . 10.0 110.702 -178.459 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -106.4 -40.78 5.49 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.907 0.883 . . . . 10.0 110.949 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.9 p -52.16 -35.0 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 CA-C-O 121.087 0.47 . . . . 10.0 110.532 170.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.6 ptmt -62.28 -46.36 89.14 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.815 1.043 . . . . 10.0 113.815 171.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 64.0 m -67.09 -32.56 73.79 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 120.886 -1.134 . . . . 10.0 110.287 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.3 t -58.15 -58.02 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 122.839 0.456 . . . . 10.0 111.004 172.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -31.47 63.79 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.73 0.641 . . . . 10.0 112.73 175.892 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.71 -32.07 67.39 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 122.848 0.459 . . . . 10.0 112.097 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 79.13 94.4 0.31 Allowed Glycine 0 CA--C 1.532 1.117 0 N-CA-C 111.473 -0.651 . . . . 10.0 111.473 -174.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.5 tp -63.17 168.85 3.89 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.854 -0.792 . . . . 10.0 111.355 175.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -48.56 -57.64 5.88 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.953 -1.092 . . . . 10.0 113.043 -171.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.15 21.48 8.82 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.421 1.488 . . . . 10.0 112.473 174.66 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 39.3 ttp -126.71 129.64 24.02 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 114.313 1.227 . . . . 10.0 114.313 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -63.15 158.03 46.31 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.481 2.121 . . . . 10.0 112.155 177.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -58.96 135.71 68.5 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.703 2.269 . . . . 10.0 110.263 -179.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.38 16.11 64.54 Favored Glycine 0 CA--C 1.527 0.841 0 O-C-N 121.742 -0.599 . . . . 10.0 113.872 -174.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 55.63 34.59 60.65 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 118.523 1.162 . . . . 10.0 112.285 -176.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 77.58 44.97 0.08 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.367 1.867 . . . . 10.0 112.529 -176.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.2 t -100.46 152.03 20.85 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.095 1.358 . . . . 10.0 110.901 171.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.5 p -108.78 -88.14 0.49 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.315 1.046 . . . . 10.0 110.132 164.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -106.14 74.93 1.07 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 126.53 1.932 . . . . 10.0 108.1 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -124.61 139.59 53.73 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.464 1.106 . . . . 10.0 110.514 174.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 93.6 m -111.43 153.16 26.51 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.845 1.258 . . . . 10.0 110.148 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -34.45 -45.02 0.21 Allowed 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 127.332 2.253 . . . . 10.0 114.54 176.272 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -41.19 -56.88 2.25 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 119.317 0.962 . . . . 10.0 113.518 170.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.12 -42.73 22.98 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.005 1.322 . . . . 10.0 112.739 175.699 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -55.25 -47.56 75.26 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.073 -1.017 . . . . 10.0 112.05 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 ptmm? -68.58 -52.21 34.24 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 108.442 -0.948 . . . . 10.0 108.442 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.75 -34.55 39.88 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.119 0.567 . . . . 10.0 112.36 177.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -64.2 -50.14 69.26 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.827 0.851 . . . . 10.0 109.811 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 8.9 mt -62.24 -44.15 98.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.181 0.993 . . . . 10.0 111.921 172.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -57.1 -37.92 72.62 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.303 1.441 . . . . 10.0 111.91 175.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -49.47 -43.41 45.04 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.476 0.547 . . . . 10.0 112.476 177.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.458 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -73.29 -69.83 0.4 Allowed 'General case' 0 CA--C 1.537 0.479 0 O-C-N 122.163 -0.336 . . . . 10.0 111.078 179.702 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.1 t -167.27 46.67 0.06 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.625 0.77 . . . . 10.0 111.807 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 37.88 60.71 1.15 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.471 1.508 . . . . 10.0 114.125 175.298 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -162.31 -82.0 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 113.232 0.827 . . . . 10.0 113.232 177.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.514 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.13 0 N-CA-C 114.74 1.385 . . . . 10.0 114.74 -173.149 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.87 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.992 0 CA-C-O 118.008 -0.996 . . . . 10.0 110.281 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -160.87 27.71 0.15 Allowed 'General case' 0 CA--C 1.548 0.89 0 CA-C-O 122.647 1.213 . . . . 10.0 110.475 176.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -93.15 62.65 3.56 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 107.955 -1.128 . . . . 10.0 107.955 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -111.8 -26.31 9.02 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.139 0.975 . . . . 10.0 113.514 173.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -151.49 115.16 4.88 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.526 0.731 . . . . 10.0 109.415 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -38.42 -43.77 0.86 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.943 1.697 . . . . 10.0 113.749 167.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -60.84 -48.08 83.43 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 117.983 0.356 . . . . 10.0 111.1 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.61 -30.89 71.28 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.509 -0.744 . . . . 10.0 110.461 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -65.63 -52.72 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-O 118.916 -0.564 . . . . 10.0 109.534 176.185 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.15 -40.48 78.17 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 118.161 -1.416 . . . . 10.0 110.858 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -68.66 -21.93 64.42 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.85 1.66 . . . . 10.0 112.738 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.82 -27.25 14.01 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 113.447 0.906 . . . . 10.0 113.447 168.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -103.46 -67.73 0.87 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.198 0.999 . . . . 10.0 112.409 -174.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.54 38.73 0.19 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.276 1.43 . . . . 10.0 111.001 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -120.39 -4.67 9.89 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 124.669 1.188 . . . . 10.0 113.782 -166.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.3 t -100.09 -40.95 8.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.346 1.058 . . . . 10.0 109.167 -169.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 m -99.46 -61.26 1.39 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.292 2.237 . . . . 10.0 110.903 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -73.44 -22.78 60.11 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.181 0.993 . . . . 10.0 113.542 -167.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.4 t -61.63 -52.48 64.17 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.573 0.749 . . . . 10.0 110.989 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -101.42 -22.38 14.57 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.328 1.051 . . . . 10.0 111.775 -179.213 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.04 52.78 2.67 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.702 1.144 . . . . 10.0 111.956 -175.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 59.7 t -96.68 160.18 2.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 125.262 1.425 . . . . 10.0 109.494 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 60.68 18.6 8.66 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.197 0.999 . . . . 10.0 113.486 -176.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 82.12 3.89 90.42 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 124.082 0.849 . . . . 10.0 113.444 -173.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.49 146.28 64.86 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-N 118.164 0.982 . . . . 10.0 113.394 -174.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -70.5 155.33 63.71 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 123.73 2.954 . . . . 10.0 109.723 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -68.95 139.68 55.06 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 119.825 -0.75 . . . . 10.0 111.573 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -32.24 -45.34 0.11 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.848 2.059 . . . . 10.0 113.45 169.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -139.28 102.14 4.42 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.004 0.922 . . . . 10.0 109.191 170.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -118.03 157.92 25.93 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.059 -1.46 . . . . 10.0 107.059 170.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 92.9 m -103.79 -35.49 8.18 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.519 0.6 . . . . 10.0 111.279 171.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.82 -23.64 36.35 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.102 -0.999 . . . . 10.0 113.269 -178.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.435 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 33.0 t0 -87.62 -22.3 24.82 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.072 1.749 . . . . 10.0 110.517 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.448 ' CZ3' ' HB2' ' A' ' 74' ' ' MET . 36.7 m95 -95.39 -35.59 11.68 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.06 1.744 . . . . 10.0 110.803 177.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -40.14 -59.54 1.8 Allowed Pre-proline 0 N--CA 1.476 0.825 0 N-CA-C 114.248 1.203 . . . . 10.0 114.248 170.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.05 17.51 0.33 Allowed 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 123.379 2.719 . . . . 10.0 113.925 -179.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.83 -43.49 2.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.426 1.89 . . . . 10.0 110.336 168.495 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.1 -13.02 5.73 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.536 1.934 . . . . 10.0 112.488 174.052 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.62 24.18 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.586 1.155 . . . . 10.0 110.513 176.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -77.01 -52.21 9.74 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.144 -0.688 . . . . 10.0 109.144 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 157.66 -116.61 0.73 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.545 1.069 . . . . 10.0 110.594 175.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . 0.405 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -149.02 -55.82 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.314 1.046 . . . . 10.0 110.331 174.63 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.442 ' HA ' HG12 ' A' ' 43' ' ' VAL . 0.8 OUTLIER -71.76 28.88 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.265 1.026 . . . . 10.0 113.515 -177.113 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.405 ' H ' ' C ' ' A' ' 39' ' ' VAL . 0.0 OUTLIER -101.53 -56.3 2.33 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 128.053 2.541 . . . . 10.0 107.217 176.607 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.668 ' HB3' HMA2 ' A' ' 90' ' ' HEC . 0.8 OUTLIER -82.65 -26.41 32.18 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.71 -0.662 . . . . 10.0 111.161 -172.725 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.461 HG23 HD13 ' A' ' 71' ' ' ILE . 1.2 p -57.17 -22.6 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 125.578 1.551 . . . . 10.0 111.767 166.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.9 mmpt? -80.62 -38.27 29.56 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.227 0.611 . . . . 10.0 111.728 169.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.84 -37.7 64.75 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 120.471 -1.393 . . . . 10.0 110.874 -176.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.442 HG12 ' HA ' ' A' ' 43' ' ' VAL . 10.7 p -61.79 -42.46 94.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.246 1.018 . . . . 10.0 110.544 173.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -35.81 76.71 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.143 0.497 . . . . 10.0 109.683 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 28.0 m -73.05 -34.34 66.22 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.153 -0.967 . . . . 10.0 111.88 177.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.54 115.65 3.72 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.457 -1.057 . . . . 10.0 110.457 -168.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.02 -152.9 0.06 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 167.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -81.51 -60.69 2.17 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.652 -1.28 . . . . 10.0 110.428 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.09 -7.21 59.2 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.448 1.499 . . . . 10.0 112.335 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.72 142.59 25.3 Favored Pre-proline 0 N--CA 1.468 0.442 0 N-CA-C 112.236 0.458 . . . . 10.0 112.236 177.344 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.66 148.0 71.04 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.376 2.051 . . . . 10.0 110.753 175.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -66.67 110.22 1.83 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.216 2.611 . . . . 10.0 109.825 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 91.52 35.9 6.74 Favored Glycine 0 C--N 1.338 0.688 0 CA-C-O 119.617 -0.546 . . . . 10.0 111.872 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 28.94 39.38 0.02 OUTLIER Glycine 0 CA--C 1.535 1.33 0 C-N-CA 127.365 2.412 . . . . 10.0 115.661 -172.049 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 62.83 -0.85 0.52 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.844 2.057 . . . . 10.0 115.793 -174.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.6 p -94.02 -29.07 15.4 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.608 1.163 . . . . 10.0 112.541 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 96.7 m 65.54 -71.34 0.08 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.149 1.38 . . . . 10.0 111.97 -178.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -79.63 54.52 1.81 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.22 1.408 . . . . 10.0 109.962 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -94.0 117.28 29.89 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.637 1.175 . . . . 10.0 109.307 -174.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 90.9 m -116.34 129.1 56.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.029 -1.101 . . . . 10.0 108.029 -174.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -37.39 -41.45 0.43 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.93 1.692 . . . . 10.0 112.533 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -35.42 -57.36 0.61 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 114.245 1.202 . . . . 10.0 114.245 169.102 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -91.94 -34.98 14.26 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.188 0.904 . . . . 10.0 111.25 173.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.95 -42.2 85.66 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.5 -1.375 . . . . 10.0 112.559 -170.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -42.73 99.9 Favored 'General case' 0 C--O 1.222 -0.35 0 O-C-N 121.353 -0.842 . . . . 10.0 109.909 174.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.39 -28.8 69.52 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.351 1.06 . . . . 10.0 111.999 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.64 -46.38 38.58 Favored 'General case' 0 C--O 1.223 -0.341 0 O-C-N 121.007 -1.058 . . . . 10.0 109.604 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.461 HD13 HG23 ' A' ' 43' ' ' VAL . 0.9 OUTLIER -61.45 -46.65 96.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 121.514 0.673 . . . . 10.0 111.407 170.667 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . 0.256 0.0 OUTLIER -59.63 -35.38 74.26 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 121.491 -0.756 . . . . 10.0 112.185 -177.866 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -44.61 -41.14 6.36 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.34 0.867 . . . . 10.0 113.34 178.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.448 ' HB2' ' CZ3' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -76.72 -67.5 0.69 Allowed 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.113 -0.367 . . . . 10.0 111.713 -177.323 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.0 t -164.07 33.81 0.08 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.696 0.798 . . . . 10.0 112.479 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt 38.23 61.27 1.14 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.863 1.265 . . . . 10.0 114.172 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -149.49 -55.57 0.18 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.073 0.949 . . . . 10.0 112.806 -178.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.642 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.2 0 C-N-CA 125.97 1.708 . . . . 10.0 112.134 -171.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.837 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.017 0 CA-C-O 117.399 -1.286 . . . . 10.0 109.359 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -161.38 91.52 0.85 Allowed 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 108.605 -0.887 . . . . 10.0 108.605 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -1' ' ' LEU . . . . . 0.428 HD22 ' O ' ' A' ' -1' ' ' LEU . 0.0 OUTLIER -144.68 30.74 1.19 Allowed 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 113.34 0.867 . . . . 10.0 113.34 -174.872 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -96.85 -21.42 17.51 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.619 0.768 . . . . 10.0 112.14 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -139.87 121.53 15.3 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 124.697 1.199 . . . . 10.0 107.996 172.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -44.84 -41.0 6.68 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.114 1.366 . . . . 10.0 113.363 168.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -59.51 -47.27 86.15 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.053 -0.405 . . . . 10.0 110.901 171.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.17 -31.3 70.76 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.705 -0.622 . . . . 10.0 111.123 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.3 mt -64.44 -53.12 46.66 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 N-CA-C 107.981 -1.118 . . . . 10.0 107.981 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.43 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.3 OUTLIER -69.69 -41.58 75.24 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 117.836 -1.545 . . . . 10.0 112.085 -177.427 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.78 -21.8 64.32 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.299 1.839 . . . . 10.0 112.566 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.65 -28.56 15.29 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.291 0.848 . . . . 10.0 113.291 168.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -108.05 -64.67 1.19 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.173 0.989 . . . . 10.0 112.652 -170.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.1 41.74 0.3 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.911 1.285 . . . . 10.0 110.552 178.302 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.2 t -126.82 4.04 6.65 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.556 1.142 . . . . 10.0 113.507 -165.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.9 t -109.75 -53.76 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 C-N-CA 125.175 1.39 . . . . 10.0 108.676 -172.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.9 m -79.31 -64.31 1.22 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.856 1.262 . . . . 10.0 110.422 173.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -73.81 -10.39 59.62 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.152 1.781 . . . . 10.0 115.058 -165.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 t -72.01 -48.18 46.57 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.92 0.488 . . . . 10.0 109.968 178.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.3 tpt -106.59 -41.07 5.36 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.155 0.982 . . . . 10.0 112.439 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 96.25 62.47 0.96 Allowed Glycine 0 CA--C 1.536 1.376 0 C-N-CA 125.495 1.522 . . . . 10.0 112.666 -175.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 95.3 t -82.41 -55.99 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 O-C-N 121.854 -0.792 . . . . 10.0 112.027 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.94 32.92 0.43 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.064 0.946 . . . . 10.0 111.079 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 66.33 16.66 65.21 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 124.635 1.112 . . . . 10.0 113.442 -173.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.29 141.46 96.23 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 113.4 0.889 . . . . 10.0 113.4 -174.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.58 138.56 38.68 Favored 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 124.764 3.642 . . . . 10.0 110.717 -176.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.4 mttm -69.32 138.54 53.86 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 121.715 -0.616 . . . . 10.0 111.157 -168.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.6 t -47.46 -36.95 10.8 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.076 0.769 . . . . 10.0 113.076 175.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -119.8 73.72 0.98 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.646 1.578 . . . . 10.0 111.889 179.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -117.74 159.8 22.4 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.046 -1.034 . . . . 10.0 109.757 171.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 57.6 m -108.33 -35.9 6.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.5 0.32 . . . . 10.0 111.39 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.01 -23.32 31.01 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 121.699 -0.625 . . . . 10.0 112.363 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -80.19 -33.86 37.88 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.859 1.663 . . . . 10.0 109.769 178.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.529 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 58.4 m95 -86.41 -35.33 19.8 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.039 1.736 . . . . 10.0 111.772 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -39.61 -59.69 1.56 Allowed Pre-proline 0 CA--C 1.548 0.887 0 O-C-N 120.272 -1.518 . . . . 10.0 114.762 172.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -75.06 15.46 0.74 Allowed 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.617 2.878 . . . . 10.0 113.528 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.615 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -116.57 -45.45 2.8 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.531 1.932 . . . . 10.0 108.176 177.609 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.414 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 1.3 mt -58.18 0.35 0.07 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 127.623 2.369 . . . . 10.0 114.208 168.063 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -84.04 -29.12 27.14 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.218 1.407 . . . . 10.0 110.076 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -94.61 -64.68 1.05 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.865 0.866 . . . . 10.0 109.359 -179.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 129.51 119.97 2.2 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 124.184 0.897 . . . . 10.0 112.127 171.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.6 m -38.59 116.06 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 114.214 1.19 . . . . 10.0 114.214 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 138.23 -19.99 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 130.142 3.377 . . . . 10.0 110.819 -169.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -78.09 -57.51 3.75 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.436 1.017 . . . . 10.0 109.985 172.236 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.528 ' HB3' HMA2 ' A' ' 90' ' ' HEC . 4.2 mp -76.7 -24.06 53.12 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.52 -0.737 . . . . 10.0 111.76 -168.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -60.15 -27.37 38.99 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 O-C-N 121.686 -0.634 . . . . 10.0 110.829 170.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.9 mmpt? -67.53 -45.84 74.56 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.347 -0.845 . . . . 10.0 110.761 171.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.9 m -62.08 -36.57 82.08 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.174 -0.953 . . . . 10.0 110.155 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.2 t -58.84 -54.13 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 121.065 0.46 . . . . 10.0 111.177 175.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -33.92 71.67 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.325 0.491 . . . . 10.0 112.325 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 58.7 m -71.56 -27.48 63.19 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.696 0.799 . . . . 10.0 112.852 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 76.67 91.93 0.23 Allowed Glycine 0 CA--C 1.53 0.985 0 CA-C-N 119.336 0.971 . . . . 10.0 112.27 -174.19 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.94 167.99 1.43 Allowed 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 122.056 0.932 . . . . 10.0 111.419 171.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.9 m120 -53.66 -55.3 27.21 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.515 -1.365 . . . . 10.0 112.417 -172.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.15 19.93 2.94 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 113.862 -1.517 . . . . 10.0 112.573 174.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.0 ttp -136.15 134.94 20.49 Favored Pre-proline 0 CA--C 1.546 0.802 0 N-CA-C 114.769 1.396 . . . . 10.0 114.769 -175.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.14 147.66 73.48 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 120.965 1.11 . . . . 10.0 111.553 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -61.5 132.61 41.51 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.251 2.634 . . . . 10.0 109.853 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.65 15.05 81.88 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 119.711 -1.233 . . . . 10.0 112.76 -172.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.09 34.63 6.03 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 118.36 1.08 . . . . 10.0 113.728 -177.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 77.18 37.92 0.25 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 126.231 1.812 . . . . 10.0 113.583 -177.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 9.8 t -126.03 164.6 20.5 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.427 1.491 . . . . 10.0 111.65 169.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.0 m -102.88 -64.06 1.11 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.686 1.194 . . . . 10.0 111.62 -178.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -122.56 46.51 2.13 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.893 1.277 . . . . 10.0 110.536 -176.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 5.4 m -71.98 116.02 11.88 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 120.824 -1.173 . . . . 10.0 110.068 172.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 t -85.08 138.85 32.16 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.284 0.634 . . . . 10.0 109.612 172.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -36.73 -40.09 0.25 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.49 1.916 . . . . 10.0 112.46 174.045 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -42.17 -55.17 3.37 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.912 1.285 . . . . 10.0 114.049 170.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -89.45 -33.85 16.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.065 0.546 . . . . 10.0 111.278 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.67 -43.79 65.77 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.417 1.087 . . . . 10.0 111.417 176.672 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -72.45 -45.15 60.88 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.86 1.264 . . . . 10.0 110.159 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -57.68 -33.5 68.41 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.432 -0.793 . . . . 10.0 111.577 174.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.56 -46.66 84.88 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 124.039 0.935 . . . . 10.0 110.561 -176.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 25.0 pt -76.59 -37.99 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 124.061 0.945 . . . . 10.0 112.28 174.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -58.19 -36.74 73.52 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.893 -0.504 . . . . 10.0 112.345 173.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -51.08 -44.96 61.3 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 174.321 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -67.62 -75.01 0.1 Allowed 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.618 0.599 . . . . 10.0 112.618 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -153.75 25.51 0.5 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.11 0.564 . . . . 10.0 111.769 -179.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 34.39 61.35 0.55 Allowed 'General case' 0 C--N 1.339 0.143 0 C-N-CA 126.895 2.078 . . . . 10.0 115.696 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.615 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -142.84 -56.76 0.43 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.311 -0.858 . . . . 10.0 112.676 -176.2 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.789 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.954 0 CA-C-O 116.624 -1.655 . . . . 10.0 112.823 -177.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.789 HMA3 ' HB2' ' A' ' 78' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.095 0 CA-C-O 117.145 -1.407 . . . . 10.0 109.271 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -164.09 128.39 2.71 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.91 1.684 . . . . 10.0 108.082 165.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -139.74 29.89 2.1 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.196 0.813 . . . . 10.0 113.196 165.007 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -96.83 -20.03 18.46 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 -167.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -141.17 131.2 24.61 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.159 -1.052 . . . . 10.0 108.159 166.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -46.29 -40.52 11.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.877 1.271 . . . . 10.0 112.783 169.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -56.24 -50.53 71.05 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.684 0.394 . . . . 10.0 111.008 171.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.15 -32.25 72.4 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.906 -0.496 . . . . 10.0 110.788 -176.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mt -64.69 -52.66 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 108.566 -0.901 . . . . 10.0 108.566 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.479 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.07 -41.58 77.35 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 117.882 -1.527 . . . . 10.0 112.033 -178.419 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -68.91 -22.13 64.18 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.757 1.623 . . . . 10.0 112.608 -176.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.0 tttp -95.77 -28.13 14.91 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.976 0.91 . . . . 10.0 113.35 170.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.403 ' O ' HMC3 ' A' ' 90' ' ' HEC . . . -109.5 -65.03 1.18 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.287 1.035 . . . . 10.0 112.318 -171.731 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.479 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.82 41.43 0.21 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.16 1.384 . . . . 10.0 111.013 178.118 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -125.41 -2.38 7.46 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 114.173 1.175 . . . . 10.0 114.173 -164.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 46.9 t -99.46 -47.99 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 124.574 1.15 . . . . 10.0 108.48 -177.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 89.9 m -95.48 -59.43 1.88 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.696 1.998 . . . . 10.0 110.602 -173.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 -74.44 -17.98 60.7 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 -171.132 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.2 t -62.84 -49.91 73.01 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 122.99 0.516 . . . . 10.0 110.465 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.3 tpt -102.84 -33.78 9.23 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.633 0.773 . . . . 10.0 112.705 176.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 101.45 56.52 0.86 Allowed Glycine 0 CA--C 1.536 1.382 0 C-N-CA 125.078 1.323 . . . . 10.0 111.572 -170.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 82.4 t -98.97 157.74 3.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.631 1.572 . . . . 10.0 109.703 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.15 24.24 11.09 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.448 1.099 . . . . 10.0 112.894 -175.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.18 5.47 87.3 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.124 0.868 . . . . 10.0 113.497 -174.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.87 145.83 77.86 Favored Pre-proline 0 CA--C 1.538 0.484 0 CA-C-N 118.771 1.286 . . . . 10.0 112.545 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -66.11 163.18 32.49 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 C-N-CA 123.599 2.866 . . . . 10.0 109.192 171.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.0 tttp -84.31 149.24 26.2 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 121.624 0.726 . . . . 10.0 110.908 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.7 p -43.28 -70.02 0.12 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.173 1.789 . . . . 10.0 111.4 170.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -103.48 119.98 39.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.823 1.649 . . . . 10.0 108.133 174.085 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -151.76 167.74 27.28 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 126.24 1.816 . . . . 10.0 108.19 171.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.0 m -110.77 -36.21 5.77 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 170.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.36 -14.03 41.85 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.288 -0.883 . . . . 10.0 113.159 -177.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -87.25 -27.21 23.07 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.515 1.926 . . . . 10.0 110.191 176.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 83.9 m95 -95.66 -38.84 10.19 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.367 1.867 . . . . 10.0 112.017 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -41.7 -57.86 3.62 Favored Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 114.682 1.364 . . . . 10.0 114.682 173.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.12 1.16 4.24 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.331 2.687 . . . . 10.0 113.949 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -102.93 -43.66 5.46 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.12 1.368 . . . . 10.0 109.237 177.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.5 5.31 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.107 1.763 . . . . 10.0 114.757 165.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.14 -30.69 18.42 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.59 1.156 . . . . 10.0 110.32 176.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -91.34 -54.66 3.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.121 0.568 . . . . 10.0 111.218 174.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 161.34 -123.14 1.18 Allowed Glycine 0 CA--C 1.533 1.186 0 N-CA-C 111.782 -0.527 . . . . 10.0 111.782 178.315 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.4 -65.54 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.271 1.029 . . . . 10.0 111.75 -177.447 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.7 15.86 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.871 1.668 . . . . 10.0 115.304 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -93.03 -48.74 6.36 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.401 1.48 . . . . 10.0 108.661 178.152 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.6 mt -81.03 -33.43 33.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 124.325 1.05 . . . . 10.0 110.13 -168.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.4 p -54.59 -32.43 25.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-O 121.651 0.738 . . . . 10.0 111.627 169.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -64.85 -41.71 95.49 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.645 -0.659 . . . . 10.0 110.892 177.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.0 m -67.69 -34.31 76.65 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.52 -0.738 . . . . 10.0 110.338 174.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.0 t -58.38 -52.51 58.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 O-C-N 121.791 -0.568 . . . . 10.0 111.173 175.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.6 -37.45 70.68 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.187 0.44 . . . . 10.0 112.187 174.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -71.87 -33.66 68.57 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.218 0.607 . . . . 10.0 111.972 -177.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.9 97.54 0.25 Allowed Glycine 0 CA--C 1.535 1.285 0 N-CA-C 111.482 -0.647 . . . . 10.0 111.482 -169.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.8 tt -61.54 167.3 3.51 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.845 -0.797 . . . . 10.0 111.197 173.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -45.51 -58.89 3.04 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.553 -1.342 . . . . 10.0 113.545 -172.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -93.98 19.36 9.16 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.312 1.445 . . . . 10.0 112.859 175.197 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 34.9 ttp -125.23 129.09 24.6 Favored Pre-proline 0 CA--C 1.553 1.084 0 N-CA-C 114.116 1.154 . . . . 10.0 114.116 173.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -63.06 158.29 44.52 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.229 1.953 . . . . 10.0 111.864 176.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -60.3 148.16 91.13 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.792 2.328 . . . . 10.0 111.021 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 53.12 31.57 41.21 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-N 115.916 -0.583 . . . . 10.0 113.598 -174.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 42.42 32.45 1.21 Allowed Glycine 0 CA--C 1.543 1.813 0 C-N-CA 124.554 1.073 . . . . 10.0 114.534 -170.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.3 ttm 81.24 27.09 0.2 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.068 2.147 . . . . 10.0 114.896 -176.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.7 t -104.76 165.63 10.94 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 120.857 -1.152 . . . . 10.0 112.172 171.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 29.4 m -100.71 -91.94 0.3 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.788 1.235 . . . . 10.0 109.682 174.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -92.57 46.53 1.25 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.441 1.096 . . . . 10.0 110.7 -173.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.61 115.89 16.78 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.692 -1.255 . . . . 10.0 109.943 175.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 93.7 m -80.16 149.82 30.39 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.514 0.725 . . . . 10.0 109.596 174.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -32.77 -55.74 0.37 Allowed 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.123 1.157 . . . . 10.0 114.123 167.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -48.22 -55.47 10.4 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.501 0.72 . . . . 10.0 111.675 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -73.57 -35.68 65.49 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.854 -0.529 . . . . 10.0 111.473 -177.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -56.94 -50.69 71.83 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.751 0.786 . . . . 10.0 110.987 172.104 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -64.58 -50.59 66.64 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.434 1.494 . . . . 10.0 109.544 -177.036 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.64 -39.67 25.02 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.033 0.533 . . . . 10.0 112.022 169.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.09 -47.71 60.75 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 120.862 -1.149 . . . . 10.0 112.186 177.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mt -55.94 -48.99 77.8 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 C-N-CA 124.85 1.26 . . . . 10.0 111.431 174.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -24.97 58.29 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.94 -1.1 . . . . 10.0 113.195 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -47.03 -50.63 19.12 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 119.152 0.887 . . . . 10.0 111.295 170.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -70.61 -44.33 67.48 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 178.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -154.2 -77.32 0.11 Allowed 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.928 -0.558 . . . . 10.0 112.35 172.056 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 157.99 58.22 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 128.697 2.799 . . . . 10.0 111.215 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -174.14 -75.96 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.809 1.411 . . . . 10.0 114.809 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.448 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 7.9 pttp . . . . . 0 C--O 1.256 1.415 0 N-CA-C 115.603 1.705 . . . . 10.0 115.603 -174.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.865 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 118.746 -0.645 . . . . 10.0 110.942 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -161.03 125.73 3.58 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.902 0.881 . . . . 10.0 110.214 -175.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.85 65.14 1.35 Allowed 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 122.168 0.985 . . . . 10.0 111.79 176.021 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.35 -24.14 12.34 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.93 0.715 . . . . 10.0 112.93 -178.438 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -142.05 124.29 15.54 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 107.302 -1.37 . . . . 10.0 107.302 171.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.407 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . . . -50.98 -37.26 43.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 172.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -55.75 -49.57 72.74 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.648 0.658 . . . . 10.0 109.864 172.42 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.64 -33.71 74.48 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.866 0.466 . . . . 10.0 111.106 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.91 -51.31 62.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 107.929 -1.137 . . . . 10.0 107.929 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.411 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -68.93 -42.1 77.22 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 119.615 1.098 . . . . 10.0 111.187 -178.842 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -68.26 -22.23 64.77 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.906 1.282 . . . . 10.0 112.639 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.9 tppt? -93.68 -28.17 16.13 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.485 1.114 . . . . 10.0 113.647 169.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -108.71 -68.87 0.89 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.387 1.475 . . . . 10.0 112.777 -171.079 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.411 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.54 45.05 0.38 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.393 1.477 . . . . 10.0 109.683 179.079 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.9 t -128.7 -5.5 5.18 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 125.388 1.475 . . . . 10.0 113.343 -167.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.1 t -101.91 -34.19 3.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 125.269 1.427 . . . . 10.0 109.171 -173.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.2 m -102.57 -63.31 1.17 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.101 2.16 . . . . 10.0 110.947 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -73.41 -24.9 60.33 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 114.062 1.134 . . . . 10.0 114.062 -162.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -58.59 -50.79 72.52 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.281 1.032 . . . . 10.0 111.339 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.6 tpt -105.07 -17.9 14.34 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.661 0.784 . . . . 10.0 112.073 -178.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.01 50.17 4.0 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 124.191 0.901 . . . . 10.0 112.17 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 47.0 t -95.51 162.17 2.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 125.344 1.458 . . . . 10.0 109.616 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.84 19.29 8.18 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.632 1.173 . . . . 10.0 113.042 -174.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.9 18.17 79.08 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 124.042 0.829 . . . . 10.0 113.003 -173.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.76 148.57 92.54 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 118.52 1.16 . . . . 10.0 112.649 -178.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.4 ' CG ' ' HE3' ' A' ' 78' ' ' LYS . 87.0 Cg_endo -76.14 153.3 36.37 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 124.958 3.772 . . . . 10.0 110.272 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -67.69 144.48 55.45 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.83 -172.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.3 m -34.26 -43.11 0.15 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.898 1.679 . . . . 10.0 113.679 169.129 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -143.61 110.31 5.56 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.661 0.743 . . . . 10.0 109.765 173.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -129.05 162.93 26.53 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 106.44 -1.689 . . . . 10.0 106.44 174.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 90.2 m -106.17 -36.2 6.97 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.756 0.707 . . . . 10.0 111.157 169.338 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.06 -26.57 59.49 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 120.63 -1.294 . . . . 10.0 112.735 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -90.07 -8.46 51.39 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.864 1.666 . . . . 10.0 110.645 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.441 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 48.5 m95 -110.73 -29.91 7.8 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.699 -1.25 . . . . 10.0 109.884 176.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -39.49 -60.58 1.24 Allowed Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 125.496 1.518 . . . . 10.0 114.292 170.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -67.99 2.4 2.65 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.295 1.997 . . . . 10.0 113.898 -177.008 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -113.51 -47.33 3.0 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.246 1.419 . . . . 10.0 110.48 176.095 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.548 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -63.34 -18.7 63.92 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.731 1.613 . . . . 10.0 112.911 173.862 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.12 -31.38 61.1 Favored 'General case' 0 N--CA 1.457 -0.104 0 C-N-CA 124.648 1.179 . . . . 10.0 109.588 178.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.1 mmtt -77.79 -56.14 4.75 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.313 171.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.09 -114.25 0.65 Allowed Glycine 0 CA--C 1.531 1.039 0 N-CA-C 111.987 -0.445 . . . . 10.0 111.987 173.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.86 168.16 19.64 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.076 0 C-N-CA 125.567 1.547 . . . . 10.0 109.796 175.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.412 ' HA ' HG12 ' A' ' 43' ' ' VAL . 0.7 OUTLIER 76.18 -34.04 0.23 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.331 1.452 . . . . 10.0 112.212 -174.204 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.3 -24.4 54.75 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 120.241 -1.537 . . . . 10.0 114.124 -177.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -105.92 -33.9 7.79 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.461 1.104 . . . . 10.0 111.939 -178.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.412 HG12 ' HA ' ' A' ' 40' ' ' ASP . 0.5 OUTLIER -56.53 -35.11 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 121.299 -0.876 . . . . 10.0 109.751 170.402 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.13 -42.72 91.29 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.972 1.101 . . . . 10.0 113.972 168.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.9 m -65.9 -39.5 90.66 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 120.688 -1.258 . . . . 10.0 110.442 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 15.6 t -56.31 -51.75 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.49 0.716 . . . . 10.0 110.811 176.604 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -62.95 -33.83 76.2 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.961 0.726 . . . . 10.0 112.961 176.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 85.3 m -72.31 -24.32 61.3 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.211 0.605 . . . . 10.0 112.314 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.28 92.56 0.3 Allowed Glycine 0 CA--C 1.533 1.218 0 CA-C-N 119.298 0.954 . . . . 10.0 112.371 -178.486 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -179.09 1.02 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.215 1.007 . . . . 10.0 111.951 175.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -55.97 -54.84 39.98 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 123.557 1.646 . . . . 10.0 111.243 -163.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.407 ' HB3' HMD2 ' A' ' 90' ' ' HEC . . . -96.93 20.77 10.59 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 128.002 2.521 . . . . 10.0 111.927 176.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -130.75 128.39 22.44 Favored Pre-proline 0 CA--C 1.545 0.76 0 N-CA-C 113.341 0.867 . . . . 10.0 113.341 -177.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -70.02 157.76 58.81 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 121.497 1.465 . . . . 10.0 111.13 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -63.83 114.11 2.45 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 123.415 2.743 . . . . 10.0 109.846 -177.311 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 92.61 11.94 58.76 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-O 119.853 -0.415 . . . . 10.0 114.097 -171.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.39 -44.06 2.39 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-N 118.692 1.246 . . . . 10.0 113.486 173.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.26 -47.31 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.793 1.637 . . . . 10.0 111.893 172.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.68 159.11 26.82 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.211 1.404 . . . . 10.0 111.673 178.296 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 86.2 m -103.6 -64.17 1.12 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.744 1.218 . . . . 10.0 112.041 175.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -80.92 56.62 2.8 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.967 0.907 . . . . 10.0 110.784 -173.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.405 ' HB2' ' CE2' ' A' ' 67' ' ' TYR . 0.0 OUTLIER -101.12 139.72 36.41 Favored 'General case' 0 CA--C 1.527 0.063 0 C-N-CA 124.642 1.177 . . . . 10.0 110.802 -173.73 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.0 m -110.77 143.93 40.53 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.12 0.968 . . . . 10.0 108.971 -176.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -47.09 -36.89 8.79 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 114.056 1.132 . . . . 10.0 114.056 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -51.33 -52.62 43.82 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.229 0.922 . . . . 10.0 111.78 170.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.76 -46.32 54.02 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.957 0.799 . . . . 10.0 110.635 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.405 ' CE2' ' HB2' ' A' ' 62' ' ' CYS . 1.6 m-85 -58.99 -51.66 69.11 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 120.838 -1.164 . . . . 10.0 111.424 -179.007 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -68.01 -45.03 75.17 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 117.673 -1.156 . . . . 10.0 109.271 -177.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.407 ' HB3' ' HB2' ' A' ' 3' ' ' ALA . . . -52.66 -31.3 36.34 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.796 1.18 . . . . 10.0 112.887 169.213 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.74 -36.55 31.89 Favored 'General case' 0 C--O 1.222 -0.342 0 O-C-N 120.694 -1.254 . . . . 10.0 112.1 -177.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.0 mt -74.24 -48.27 37.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 125.154 1.381 . . . . 10.0 111.281 174.015 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -27.75 67.2 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.414 1.086 . . . . 10.0 113.312 175.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 32.4 t80 -46.23 -38.72 8.81 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.666 0.617 . . . . 10.0 112.666 171.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.441 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -87.36 -71.29 0.57 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 122.946 0.498 . . . . 10.0 112.018 -177.356 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.3 t -160.13 36.49 0.17 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.495 0.718 . . . . 10.0 112.312 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.5 ptmm? 33.23 66.55 0.21 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 126.349 1.859 . . . . 10.0 114.796 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.548 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -163.17 -49.18 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.141 -0.936 . . . . 10.0 113.356 -178.209 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.436 ' HE2' ' C3A' ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.72 0 CA-C-O 118.089 -0.958 . . . . 10.0 111.511 179.279 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.707 HMC1 ' CBC' ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.168 0 N-CA-C 114.008 1.114 . . . . 10.0 114.008 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -164.01 130.03 3.05 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.611 0.764 . . . . 10.0 109.514 -171.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -1' ' ' LEU . . . . . 0.671 HD13 ' CD1' ' A' ' 6' ' ' ILE . 2.0 mm? -78.0 54.65 1.34 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.149 0.98 . . . . 10.0 111.326 -178.512 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -111.23 -22.07 11.58 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.656 1.582 . . . . 10.0 112.931 -178.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -151.87 121.07 6.73 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.191 0.996 . . . . 10.0 109.782 -174.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -42.83 -44.39 4.45 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.132 1.373 . . . . 10.0 113.693 170.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -55.96 -50.99 69.25 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.94 0.4 . . . . 10.0 110.312 175.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.33 -31.83 70.54 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.775 -0.578 . . . . 10.0 111.27 -176.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.671 ' CD1' HD13 ' A' ' -1' ' ' LEU . 44.1 mt -67.59 -51.94 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 178.243 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.24 -41.68 76.64 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 119.077 -1.049 . . . . 10.0 111.025 178.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -67.15 -21.42 65.82 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.315 1.446 . . . . 10.0 112.161 -177.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.41 -27.53 18.26 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.445 1.276 . . . . 10.0 114.445 166.801 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.69 -70.7 0.8 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.796 1.238 . . . . 10.0 111.582 -168.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.98 38.69 0.17 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.115 1.766 . . . . 10.0 110.224 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.9 t -119.26 -6.13 10.38 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 125.301 1.44 . . . . 10.0 113.833 -167.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.7 t -93.86 -38.06 9.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-O 122.322 1.058 . . . . 10.0 108.304 -175.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.6 m -110.83 -60.18 1.86 Allowed 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 126.474 1.909 . . . . 10.0 109.507 -167.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -74.49 -26.12 59.81 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 114.061 1.134 . . . . 10.0 114.061 -170.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 t -58.55 -55.0 40.72 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.966 0.906 . . . . 10.0 110.916 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.8 mmt -101.07 -23.87 14.41 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.645 1.178 . . . . 10.0 112.06 -178.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.64 52.93 2.7 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 124.92 1.248 . . . . 10.0 112.08 -174.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.7 t -93.25 156.17 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 125.389 1.475 . . . . 10.0 109.525 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.78 25.05 11.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.263 1.025 . . . . 10.0 113.106 -176.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.06 12.05 83.62 Favored Glycine 0 CA--C 1.535 1.306 0 C-N-CA 123.83 0.729 . . . . 10.0 113.206 -175.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.14 152.31 72.2 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 118.289 1.044 . . . . 10.0 111.995 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.26 169.51 21.85 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.739 2.959 . . . . 10.0 110.538 -177.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -78.07 146.68 35.11 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.634 -0.666 . . . . 10.0 112.382 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.17 -30.32 6.66 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.093 1.357 . . . . 10.0 113.976 168.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.6 p80 -146.44 114.92 6.75 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.045 -1.034 . . . . 10.0 110.006 174.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.412 HD22 ' CG ' ' A' ' 30' ' ' ASP . 5.3 m-20 -144.54 168.47 20.08 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.782 -1.192 . . . . 10.0 107.782 174.297 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 97.5 m -109.61 -32.38 7.13 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 119.294 -0.384 . . . . 10.0 110.955 167.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.57 -28.4 45.88 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 114.6 1.333 . . . . 10.0 114.6 -175.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.412 ' CG ' HD22 ' A' ' 27' ' ' ASN . 0.7 OUTLIER -81.15 -33.45 33.14 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.908 0.861 . . . . 10.0 109.498 176.061 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.452 ' CE3' ' HB2' ' A' ' 75' ' ' SER . 62.7 m95 -77.7 -41.08 39.21 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.155 0.982 . . . . 10.0 109.997 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -39.92 -65.04 0.46 Allowed Pre-proline 0 CA--C 1.549 0.907 0 CA-C-N 120.627 1.558 . . . . 10.0 114.9 174.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -70.9 -0.65 8.19 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 123.512 2.808 . . . . 10.0 113.495 -178.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.72 -34.67 9.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.311 1.444 . . . . 10.0 109.905 170.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 tp -98.53 20.68 12.38 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 128.228 2.611 . . . . 10.0 111.998 -173.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -106.89 16.29 24.48 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.638 1.575 . . . . 10.0 110.346 174.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -133.2 -45.3 0.84 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 126.434 1.894 . . . . 10.0 110.504 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 163.46 -142.59 7.96 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 109.343 -1.503 . . . . 10.0 109.343 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.1 t -129.75 -55.01 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 123.783 0.833 . . . . 10.0 109.737 -177.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.64 32.93 0.08 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.216 1.806 . . . . 10.0 113.294 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -106.06 -46.56 4.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 128.151 2.58 . . . . 10.0 108.044 176.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 42' ' ' LEU . 1.4 mm? -83.17 -40.22 19.99 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.016 0.927 . . . . 10.0 111.51 -173.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 p -55.9 -26.6 21.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-O 121.612 0.72 . . . . 10.0 110.523 171.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.3 mmtt -72.6 -37.35 68.15 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.333 -0.854 . . . . 10.0 112.561 173.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.7 m -67.25 -32.98 74.37 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.973 0.892 . . . . 10.0 110.573 174.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.5 t -57.84 -49.33 81.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 O-C-N 121.443 -0.785 . . . . 10.0 111.858 171.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -28.45 69.66 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.062 0.764 . . . . 10.0 113.062 -177.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.0 p -83.59 -29.62 27.62 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.941 0.719 . . . . 10.0 112.941 174.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.0 101.22 0.33 Allowed Glycine 0 CA--C 1.527 0.818 0 CA-C-N 118.663 0.665 . . . . 10.0 112.445 -171.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.27 173.94 1.36 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.437 0.637 . . . . 10.0 111.141 165.22 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -47.69 -57.88 4.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.439 1.496 . . . . 10.0 114.136 -167.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -99.26 23.48 9.15 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.359 1.464 . . . . 10.0 111.264 177.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -112.55 154.99 44.48 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 114.735 1.383 . . . . 10.0 114.735 172.053 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -76.06 134.44 16.1 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 122.782 2.321 . . . . 10.0 110.539 175.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -66.56 117.27 4.6 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.124 2.549 . . . . 10.0 110.288 178.224 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.76 30.91 10.7 Favored Glycine 0 C--N 1.343 0.926 0 C-N-CA 120.102 -1.047 . . . . 10.0 110.546 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.18 38.5 6.41 Favored Glycine 0 CA--C 1.531 1.054 0 CA-C-N 117.728 0.764 . . . . 10.0 114.482 178.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 73.48 -59.51 0.56 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.163 1.385 . . . . 10.0 111.367 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.4 t -82.76 98.31 9.03 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 125.151 1.38 . . . . 10.0 110.798 170.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.1 t -59.91 -42.11 93.16 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.422 169.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -79.41 57.22 2.32 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.036 1.334 . . . . 10.0 111.189 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.658 ' SG ' HD11 ' A' ' -1' ' ' LEU . 1.9 m -127.97 134.43 49.28 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 126.105 1.762 . . . . 10.0 110.975 -175.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 m -103.75 141.7 35.64 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.772 0.829 . . . . 10.0 109.942 -178.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -44.32 -34.95 2.13 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.028 1.121 . . . . 10.0 114.028 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -45.42 -56.65 4.78 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.502 1.121 . . . . 10.0 110.807 169.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.89 -44.59 26.64 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.434 1.494 . . . . 10.0 108.8 -175.075 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -47.43 85.65 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.012 1.325 . . . . 10.0 110.542 -174.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.0 mtpm? -69.48 -44.46 71.11 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.526 -0.733 . . . . 10.0 111.144 174.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.59 -27.41 6.75 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 119.288 0.949 . . . . 10.0 112.905 170.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.11 -46.48 11.9 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.139 -0.976 . . . . 10.0 110.656 173.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.2 tp -53.42 -34.94 23.86 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.695 1.198 . . . . 10.0 113.214 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.44 -17.95 29.34 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.288 1.435 . . . . 10.0 113.214 177.37 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -53.05 -44.99 67.85 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.402 -0.811 . . . . 10.0 111.941 174.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.3 mpp? -71.62 -62.19 1.5 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.479 1.112 . . . . 10.0 112.362 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.452 ' HB2' ' CE3' ' A' ' 31' ' ' TRP . 15.4 m -141.66 -93.84 0.14 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.215 1.006 . . . . 10.0 110.056 172.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.8 ptmt -174.89 56.11 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.984 1.313 . . . . 10.0 109.022 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.71 -75.38 0.05 Allowed 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 114.26 1.207 . . . . 10.0 114.26 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.41 ' HG3' ' CE3' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.186 0 N-CA-C 115.761 1.763 . . . . 10.0 115.761 -160.376 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.811 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.083 0 CA-C-O 117.79 -1.1 . . . . 10.0 109.445 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -162.18 125.91 3.1 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.955 -0.758 . . . . 10.0 108.955 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.27 69.38 3.54 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.344 1.069 . . . . 10.0 110.088 -178.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.13 -21.64 11.84 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.424 1.489 . . . . 10.0 112.47 171.27 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -147.22 122.75 10.42 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.433 0.635 . . . . 10.0 109.459 -176.407 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -45.25 -40.77 7.81 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.794 1.238 . . . . 10.0 113.522 167.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -54.87 -50.82 67.76 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-N 118.117 0.417 . . . . 10.0 110.617 172.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.38 -31.52 70.95 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 122.022 -0.424 . . . . 10.0 110.647 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.75 -51.99 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 108.633 -0.877 . . . . 10.0 108.633 177.234 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.429 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.74 -41.95 74.59 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 118.951 -1.1 . . . . 10.0 111.251 -177.954 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -68.17 -22.05 64.86 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.809 1.644 . . . . 10.0 112.16 -177.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.42 -29.07 16.47 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.932 1.086 . . . . 10.0 113.932 166.535 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.478 ' O ' HMC3 ' A' ' 90' ' ' HEC . . . -106.05 -67.27 0.94 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.263 1.025 . . . . 10.0 112.933 -170.547 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.429 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.73 43.05 0.39 Allowed 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.883 1.273 . . . . 10.0 109.374 -179.1 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 t -126.79 -5.0 6.37 Favored 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 125.333 1.453 . . . . 10.0 113.501 -165.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 41.2 t -99.02 -51.63 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 124.985 1.314 . . . . 10.0 108.083 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 80.4 m -92.01 -59.01 2.21 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.426 1.891 . . . . 10.0 109.906 -174.091 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 -73.97 -16.92 61.06 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.033 1.123 . . . . 10.0 114.033 -171.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.7 t -65.34 -50.01 67.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.766 -0.584 . . . . 10.0 111.24 -178.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 tpt -106.96 -26.27 11.26 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.291 1.036 . . . . 10.0 112.256 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.78 55.22 1.33 Allowed Glycine 0 CA--C 1.535 1.343 0 C-N-CA 125.211 1.386 . . . . 10.0 111.9 -174.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 90.8 t -95.6 156.46 3.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 125.291 1.437 . . . . 10.0 109.69 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.12 25.95 11.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.218 1.007 . . . . 10.0 112.802 -174.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.74 7.44 88.21 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.105 0.86 . . . . 10.0 113.508 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.43 147.03 92.73 Favored Pre-proline 0 CA--C 1.55 0.977 0 CA-C-N 118.807 1.304 . . . . 10.0 112.35 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -67.12 172.23 10.22 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 125.099 3.866 . . . . 10.0 110.29 172.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -124.26 135.33 53.33 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.763 0.825 . . . . 10.0 111.52 -176.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 p -78.79 52.89 1.28 Allowed 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.825 -1.172 . . . . 10.0 113.166 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.1 p-80 -146.54 -43.3 0.19 Allowed 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.885 1.439 . . . . 10.0 114.885 178.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.67 146.13 32.62 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.932 1.293 . . . . 10.0 108.877 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 38.2 m -94.44 -29.0 15.19 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.253 0.933 . . . . 10.0 110.155 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.46 -29.85 68.1 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.689 0.996 . . . . 10.0 113.689 177.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.458 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 60.7 t0 -71.32 -34.03 70.2 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.434 1.094 . . . . 10.0 109.26 174.384 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.434 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 49.0 m95 -90.03 -31.27 17.26 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 125.094 1.358 . . . . 10.0 113.254 -175.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -47.01 -56.59 11.48 Favored Pre-proline 0 CA--C 1.541 0.613 0 O-C-N 120.493 -1.379 . . . . 10.0 114.603 174.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.43 -0.02 4.59 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 122.579 2.186 . . . . 10.0 113.278 -178.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -93.6 -49.19 6.0 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.499 -0.751 . . . . 10.0 109.567 170.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.36 22.8 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.533 1.308 . . . . 10.0 114.533 170.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -93.94 -37.76 11.53 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.396 1.078 . . . . 10.0 109.698 176.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt -85.83 -46.01 11.04 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.948 0.899 . . . . 10.0 111.151 175.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 152.81 -143.58 10.46 Favored Glycine 0 CA--C 1.534 1.248 0 N-CA-C 110.353 -1.099 . . . . 10.0 110.353 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.8 t -123.76 -54.53 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.194 0.998 . . . . 10.0 110.901 -174.212 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.95 -13.85 7.6 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.443 1.497 . . . . 10.0 113.207 -178.343 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -72.84 -16.04 61.61 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 126.093 1.757 . . . . 10.0 113.47 175.993 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 mp -103.9 -43.99 5.16 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.228 0.611 . . . . 10.0 110.379 -171.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.3 p -53.8 -34.15 24.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.05 0.54 . . . . 10.0 111.103 170.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.6 ptmt -63.51 -43.96 95.68 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.823 -1.173 . . . . 10.0 113.91 170.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.5 m -66.55 -32.72 74.24 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 120.631 -1.293 . . . . 10.0 110.034 -178.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 40.5 t -60.43 -54.89 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 123.563 0.745 . . . . 10.0 111.099 172.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.62 -31.9 69.92 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.903 0.705 . . . . 10.0 112.903 178.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.8 m -71.1 -27.48 63.62 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.442 0.697 . . . . 10.0 112.471 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 74.31 90.68 0.17 Allowed Glycine 0 CA--C 1.529 0.969 0 CA-C-N 119.196 0.907 . . . . 10.0 112.539 -175.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.41 168.51 2.71 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.961 0.886 . . . . 10.0 111.634 173.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -52.98 -57.96 8.58 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 120.468 -1.395 . . . . 10.0 112.85 -169.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.6 17.94 3.04 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.189 1.396 . . . . 10.0 112.722 173.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ttp -131.66 130.26 22.31 Favored Pre-proline 0 CA--C 1.545 0.763 0 N-CA-C 115.021 1.489 . . . . 10.0 115.021 -175.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.08 143.04 76.98 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 121.452 1.434 . . . . 10.0 112.309 -178.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -61.92 133.06 42.53 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 123.679 2.919 . . . . 10.0 109.946 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.79 11.75 85.13 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 119.579 -1.296 . . . . 10.0 112.735 -173.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 56.81 53.94 40.32 Favored Glycine 0 CA--C 1.532 1.138 0 O-C-N 120.74 -1.447 . . . . 10.0 110.88 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 80.12 -45.52 0.29 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.835 2.054 . . . . 10.0 112.603 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.08 162.39 25.89 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.642 0.777 . . . . 10.0 111.583 175.019 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.7 m -114.42 -57.41 2.28 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.315 1.046 . . . . 10.0 110.504 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -82.48 68.03 8.76 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 122.418 1.104 . . . . 10.0 109.871 -178.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.76 116.79 32.34 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.837 1.655 . . . . 10.0 110.432 -177.332 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -84.48 130.63 34.74 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 126.557 1.943 . . . . 10.0 109.334 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -45.58 -35.72 4.19 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.898 0.879 . . . . 10.0 113.261 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -50.17 -59.76 3.62 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.187 0.995 . . . . 10.0 113.162 167.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -74.62 -26.47 59.92 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 120.961 -1.087 . . . . 10.0 109.907 -177.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -55.82 14.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.909 1.284 . . . . 10.0 110.959 177.316 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.55 -44.49 96.93 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 177.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.75 -24.96 38.34 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.412 0.523 . . . . 10.0 112.412 173.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -85.61 -48.0 9.3 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.534 -0.729 . . . . 10.0 109.86 176.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.2 tp -57.42 -30.33 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.705 1.602 . . . . 10.0 112.747 178.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.63 -28.56 23.14 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.205 1.002 . . . . 10.0 113.549 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -51.87 -51.35 57.33 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.431 1.014 . . . . 10.0 112.139 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.434 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.3 mpp? -64.96 -36.87 85.78 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.718 0.636 . . . . 10.0 112.718 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -166.8 -74.18 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.465 0.706 . . . . 10.0 110.934 172.12 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 164.1 43.58 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 128.281 2.632 . . . . 10.0 110.842 -170.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.63 -81.58 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 115.418 1.636 . . . . 10.0 115.418 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.458 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 3.0 ptpt . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.282 -1.342 . . . . 10.0 113.925 -176.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.88 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 117.934 -1.032 . . . . 10.0 109.188 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -162.16 35.75 0.12 Allowed 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 122.68 1.228 . . . . 10.0 111.377 -164.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -1' ' ' LEU . . . . . 0.798 HD13 ' H ' ' A' ' -1' ' ' LEU . 0.0 OUTLIER -74.07 51.23 0.4 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.001 2.12 . . . . 10.0 112.245 172.278 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -101.51 -23.07 14.37 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.76 1.224 . . . . 10.0 111.013 173.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 58.5 t0 -149.52 119.82 7.32 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.198 0.999 . . . . 10.0 110.007 173.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -44.52 -42.34 7.12 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.004 1.321 . . . . 10.0 113.93 167.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -57.94 -46.58 84.83 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 122.208 -0.307 . . . . 10.0 110.428 173.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.41 -34.18 76.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.963 -0.461 . . . . 10.0 110.701 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.5 mm -64.86 -51.25 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 O-C-N 121.575 -0.703 . . . . 10.0 109.143 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.414 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.1 -42.01 76.68 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 117.791 -1.563 . . . . 10.0 111.988 179.514 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.61 -22.0 64.47 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.513 1.525 . . . . 10.0 112.579 -176.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -92.64 -29.21 16.24 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.548 1.139 . . . . 10.0 113.249 170.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.18 -64.49 1.29 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.143 0.977 . . . . 10.0 112.995 -170.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.414 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.04 37.81 0.16 Allowed 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.811 1.244 . . . . 10.0 110.887 178.184 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -120.57 -1.35 10.1 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 125.024 1.329 . . . . 10.0 113.316 -165.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.2 t -105.66 -46.57 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 124.647 1.179 . . . . 10.0 108.874 -171.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.9 m -87.82 -64.52 1.14 Allowed 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 125.703 1.601 . . . . 10.0 111.571 174.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -72.57 -25.57 61.4 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.565 0.746 . . . . 10.0 112.993 -162.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.8 t -55.01 -50.31 69.36 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.874 1.269 . . . . 10.0 111.094 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.5 tpt -106.08 -21.29 13.17 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.945 0.898 . . . . 10.0 112.635 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.56 45.27 3.76 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.138 0.875 . . . . 10.0 112.353 -176.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 57.7 t -86.06 160.18 3.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 124.568 1.147 . . . . 10.0 109.384 177.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.97 17.16 5.15 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.806 1.243 . . . . 10.0 113.531 -175.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.84 18.38 78.91 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.128 0.87 . . . . 10.0 113.417 -173.416 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.0 143.55 98.02 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-N 118.507 1.154 . . . . 10.0 112.831 -177.112 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -66.96 147.47 80.31 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.142 3.228 . . . . 10.0 110.118 177.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -69.1 139.49 54.77 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.792 -167.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 72.4 m -37.96 -35.3 0.15 Allowed 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.48 1.512 . . . . 10.0 114.512 173.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -141.94 108.75 5.4 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.737 1.615 . . . . 10.0 107.862 174.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -135.28 167.28 21.31 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.757 1.623 . . . . 10.0 106.737 171.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 88.2 m -110.84 -35.77 5.87 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.385 0.539 . . . . 10.0 112.123 171.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.05 -17.19 44.13 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 121.119 -0.988 . . . . 10.0 113.072 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -85.23 -29.77 24.39 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.272 1.829 . . . . 10.0 110.114 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.462 ' CZ3' ' HB2' ' A' ' 74' ' ' MET . 50.4 m95 -92.61 -38.34 11.94 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.869 2.068 . . . . 10.0 111.204 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -41.78 -60.52 1.89 Allowed Pre-proline 0 CA--C 1.552 1.038 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 173.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -64.24 -4.79 8.43 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.561 2.841 . . . . 10.0 114.053 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -98.25 -53.02 3.48 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.748 1.619 . . . . 10.0 108.308 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.475 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 1.4 mt -58.9 -19.39 41.79 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.566 1.547 . . . . 10.0 113.338 174.019 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.16 -30.58 55.07 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.143 1.377 . . . . 10.0 109.488 -177.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -82.57 -52.2 7.05 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.854 -0.424 . . . . 10.0 109.854 174.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 167.99 -125.26 1.28 Allowed Glycine 0 CA--C 1.532 1.106 0 N-CA-C 111.339 -0.704 . . . . 10.0 111.339 177.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.7 t -141.61 -59.71 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-O 122.105 0.955 . . . . 10.0 109.461 -178.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -71.69 17.35 0.09 Allowed 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 124.277 1.031 . . . . 10.0 112.652 -173.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.43 -18.36 18.29 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 128.249 2.62 . . . . 10.0 110.39 177.366 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -101.51 -41.92 6.44 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.999 0.92 . . . . 10.0 111.053 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.3 p -49.62 -35.38 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-O 121.477 0.656 . . . . 10.0 111.264 170.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 ptmt -63.66 -44.39 93.91 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 114.707 1.373 . . . . 10.0 114.707 172.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.14 -23.61 63.03 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 119.156 0.889 . . . . 10.0 110.91 178.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.0 t -67.33 -53.92 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 O-C-N 121.584 -0.697 . . . . 10.0 111.703 168.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.51 -34.82 74.65 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.949 -0.469 . . . . 10.0 112.035 177.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.64 -31.32 61.92 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.39 0.676 . . . . 10.0 112.169 177.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.0 105.5 0.15 Allowed Glycine 0 C--N 1.341 0.808 0 N-CA-C 111.485 -0.646 . . . . 10.0 111.485 -166.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.5 tp -63.14 172.01 2.04 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.877 -0.778 . . . . 10.0 110.247 167.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -49.02 -58.27 5.18 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.742 1.217 . . . . 10.0 113.488 -169.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -86.09 18.97 2.81 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.018 1.327 . . . . 10.0 112.923 174.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 5.9 mtp -119.24 147.28 42.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 N-CA-C 114.269 1.211 . . . . 10.0 114.269 173.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.29 141.44 32.13 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.137 1.891 . . . . 10.0 110.425 172.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -61.6 124.36 14.48 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.003 2.469 . . . . 10.0 109.884 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.67 17.03 57.52 Favored Glycine 0 C--N 1.34 0.776 0 C-N-CA 119.994 -1.098 . . . . 10.0 111.824 -178.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 52.93 36.3 50.51 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 118.875 1.337 . . . . 10.0 113.511 172.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 66.54 21.99 10.65 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.323 1.849 . . . . 10.0 114.102 -175.316 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.9 t -122.74 166.61 14.65 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.287 1.835 . . . . 10.0 110.577 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.8 t -115.47 -55.59 2.43 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.393 1.077 . . . . 10.0 111.551 177.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -115.43 49.97 1.04 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.714 1.206 . . . . 10.0 110.99 -177.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.9 m -80.09 117.54 20.99 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 120.394 -1.441 . . . . 10.0 110.624 174.74 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 34.7 p -79.7 139.0 37.51 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -45.51 -32.22 2.14 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.757 0.823 . . . . 10.0 113.202 176.765 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -52.61 -61.8 2.05 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 119.257 0.935 . . . . 10.0 112.535 169.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -27.77 62.39 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.551 -0.718 . . . . 10.0 110.495 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -50.02 45.45 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.46 1.124 . . . . 10.0 109.972 -177.521 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -64.85 -51.65 60.88 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 124.58 1.152 . . . . 10.0 109.021 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.43 -35.07 12.07 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 118.871 0.759 . . . . 10.0 112.523 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.27 -34.04 61.31 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 120.946 -1.096 . . . . 10.0 112.213 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.65 -51.57 27.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.048 1.739 . . . . 10.0 110.7 175.383 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.6 -28.32 69.84 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.033 1.333 . . . . 10.0 112.881 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -42.16 -41.34 2.64 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.884 0.698 . . . . 10.0 112.884 170.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.462 ' HB2' ' CZ3' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -77.59 -69.77 0.52 Allowed 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 111.998 0.369 . . . . 10.0 111.998 179.854 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.8 t -163.08 32.23 0.09 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.685 0.995 . . . . 10.0 113.685 -176.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 37.29 53.95 1.3 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.443 1.897 . . . . 10.0 115.047 177.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.475 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -140.77 -54.64 0.5 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.923 0.889 . . . . 10.0 112.836 -177.054 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.534 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.898 0 CA-C-O 116.666 -1.635 . . . . 10.0 110.559 171.184 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.71 HMC1 ' CBC' ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.897 0 CA-C-O 118.589 -0.72 . . . . 10.0 111.357 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -162.39 129.48 3.73 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.734 0.642 . . . . 10.0 112.734 -170.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.51 76.24 1.45 Allowed 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 122.676 1.227 . . . . 10.0 109.123 171.649 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.85 -24.96 8.84 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.928 1.291 . . . . 10.0 114.281 175.37 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -136.93 -168.09 2.21 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 106.218 -1.771 . . . . 10.0 106.218 -177.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -103.34 -41.75 5.93 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 127.522 2.329 . . . . 10.0 111.998 176.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -54.85 -51.5 65.7 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 122.195 0.997 . . . . 10.0 109.772 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.96 -30.08 69.28 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.144 -0.935 . . . . 10.0 110.858 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.56 -52.0 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.68 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.404 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.5 OUTLIER -69.71 -40.08 76.49 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.758 0.708 . . . . 10.0 110.39 -176.769 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -68.94 -23.95 64.21 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.391 1.077 . . . . 10.0 112.035 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.41 -30.66 19.32 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.612 1.338 . . . . 10.0 114.612 166.335 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.65 -69.54 0.86 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.959 1.304 . . . . 10.0 111.637 -167.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.404 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.38 43.95 0.25 Allowed 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 125.516 1.526 . . . . 10.0 110.345 178.612 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.9 t -127.1 -7.13 5.98 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.701 1.601 . . . . 10.0 113.668 -167.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 48.4 t -94.17 -42.72 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 N-CA-C 108.243 -1.021 . . . . 10.0 108.243 -175.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.9 m -104.97 -57.2 2.06 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.737 1.615 . . . . 10.0 109.358 -173.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -74.13 -14.77 61.02 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 114.825 1.417 . . . . 10.0 114.825 -171.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.6 t -70.24 -43.99 69.44 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.434 0.693 . . . . 10.0 110.408 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 25.5 mmt -114.64 -40.42 3.58 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.271 1.428 . . . . 10.0 112.247 -175.422 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.21 61.67 1.13 Allowed Glycine 0 CA--C 1.535 1.322 0 C-N-CA 125.737 1.637 . . . . 10.0 112.682 -178.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 94.0 t -82.65 -56.53 5.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 121.631 0.729 . . . . 10.0 111.991 -175.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.97 30.79 0.44 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.909 0.884 . . . . 10.0 111.211 177.058 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 65.83 18.41 66.32 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 124.026 0.822 . . . . 10.0 113.195 -172.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.23 142.88 97.79 Favored Pre-proline 0 CA--C 1.539 0.536 0 O-C-N 121.681 -0.894 . . . . 10.0 111.676 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -75.27 149.38 35.55 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 122.841 2.361 . . . . 10.0 111.182 -172.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -63.58 134.5 55.6 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.041 -0.527 . . . . 10.0 112.34 -175.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.1 p -48.08 -22.96 0.7 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.079 1.752 . . . . 10.0 114.453 173.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.76 40.14 1.84 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.135 0.879 . . . . 10.0 113.125 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -77.09 151.36 35.48 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.524 -0.735 . . . . 10.0 110.607 169.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.3 m -107.51 -30.57 8.56 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.704 0.402 . . . . 10.0 110.978 165.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.63 -36.58 70.78 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.945 -1.097 . . . . 10.0 113.179 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -79.23 -30.18 43.09 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.91 0.862 . . . . 10.0 110.281 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.9 m95 -82.48 -31.56 29.28 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.967 1.707 . . . . 10.0 111.751 178.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -40.7 -62.04 1.08 Allowed Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.07 1.348 . . . . 10.0 113.954 172.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.17 6.66 2.08 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.851 2.367 . . . . 10.0 113.787 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.482 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 29.2 mmt180 -108.49 -42.63 4.51 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.18 1.392 . . . . 10.0 109.345 177.457 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.05 6.12 2.32 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.081 1.752 . . . . 10.0 112.823 176.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.19 -34.96 37.01 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.53 1.532 . . . . 10.0 109.205 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -80.92 -61.01 2.09 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.3 170.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 150.17 -127.94 2.54 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.428 -0.669 . . . . 10.0 111.428 175.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.9 m -122.42 172.77 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 126.331 1.852 . . . . 10.0 109.172 175.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 63.15 9.5 3.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.838 1.255 . . . . 10.0 113.832 -176.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -92.63 -62.14 1.45 Allowed 'General case' 0 C--N 1.343 0.295 0 CA-C-O 122.419 1.104 . . . . 10.0 108.913 170.129 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.66 -26.66 60.01 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.734 0.814 . . . . 10.0 111.468 -172.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.01 -29.43 46.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 O-C-N 121.611 -0.681 . . . . 10.0 110.371 173.315 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -69.28 -43.0 74.76 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.538 -0.727 . . . . 10.0 110.976 176.109 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -39.09 93.08 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.507 -0.746 . . . . 10.0 109.939 176.196 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.431 HG12 ' CZ ' ' A' ' 67' ' ' TYR . 2.4 t -56.12 -48.55 78.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.407 0.623 . . . . 10.0 111.85 178.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.97 -32.01 72.97 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.896 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 54.6 m -74.47 -29.66 61.54 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.083 0.953 . . . . 10.0 113.547 175.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.29 117.98 0.35 Allowed Glycine 0 CA--C 1.529 0.962 0 CA-C-N 119.306 0.957 . . . . 10.0 111.496 -170.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.6 tp -72.56 -145.3 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.162 0.985 . . . . 10.0 110.628 168.03 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -80.64 -67.24 0.79 Allowed 'General case' 0 N--CA 1.477 0.893 0 O-C-N 119.648 -1.907 . . . . 10.0 111.301 -174.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.2 -14.74 60.14 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.276 1.43 . . . . 10.0 111.381 176.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 ttp -97.67 120.44 60.48 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 123.726 0.81 . . . . 10.0 110.862 -175.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -70.74 157.22 59.11 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 121.718 1.612 . . . . 10.0 111.31 -175.456 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -62.49 116.88 3.8 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 123.031 2.488 . . . . 10.0 110.23 -179.166 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 98.49 35.91 4.78 Favored Glycine 0 C--N 1.344 1.018 0 CA-C-N 118.058 0.39 . . . . 10.0 113.104 -176.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 53.39 -86.66 0.01 OUTLIER Glycine 0 CA--C 1.537 1.425 0 C-N-CA 124.533 1.063 . . . . 10.0 113.998 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.6 ttt -171.98 40.16 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 127.242 2.217 . . . . 10.0 110.226 172.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.8 p -131.29 170.76 14.17 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.56 1.319 . . . . 10.0 114.56 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 55.3 m -81.99 -98.77 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.928 1.291 . . . . 10.0 109.966 175.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -82.35 64.29 6.94 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.957 -1.089 . . . . 10.0 109.434 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 4.2 m -60.75 86.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.807 0 CA-C-O 121.301 0.572 . . . . 10.0 111.495 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.3 p -78.23 132.27 37.48 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 120.776 -1.203 . . . . 10.0 108.186 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -46.77 -32.04 3.4 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.966 0.906 . . . . 10.0 112.515 178.049 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -52.72 -59.48 4.43 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.327 1.451 . . . . 10.0 113.968 166.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -73.89 -36.07 64.75 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 107.932 -1.136 . . . . 10.0 107.932 -175.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.431 ' CZ ' HG12 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -55.92 -60.24 3.75 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 123.165 0.586 . . . . 10.0 111.064 172.618 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.8 ptmt -57.82 -48.32 80.09 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.338 1.055 . . . . 10.0 109.873 -177.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.94 -22.25 14.42 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.758 0.651 . . . . 10.0 112.758 172.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -101.79 -9.82 20.46 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 124.701 1.2 . . . . 10.0 113.859 -174.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.412 HG22 ' O ' ' A' ' 67' ' ' TYR . 0.0 OUTLIER -99.94 -38.76 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.962 0.905 . . . . 10.0 109.809 167.36 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -37.93 77.36 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.322 0.649 . . . . 10.0 111.698 175.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -49.93 -38.56 36.85 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.015 0.926 . . . . 10.0 112.462 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -79.35 -65.17 1.03 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.625 0.37 . . . . 10.0 111.991 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 t -164.3 27.94 0.07 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 119.451 -0.9 . . . . 10.0 112.917 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt 40.0 46.81 1.84 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.784 0.834 . . . . 10.0 113.134 -175.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.482 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -132.64 -84.66 0.47 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.887 1.275 . . . . 10.0 113.435 173.157 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.277 0 N-CA-C 115.651 1.722 . . . . 10.0 115.651 -164.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.904 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 121.126 0.488 . . . . 10.0 110.134 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -178.6 115.13 0.07 Allowed 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 106.969 -1.493 . . . . 10.0 106.969 -156.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' -1' ' ' LEU . . . . . 0.411 ' HA ' HD11 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -145.79 32.86 1.03 Allowed 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 113.325 0.861 . . . . 10.0 113.325 -177.148 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 8.4 mp0 -97.3 -25.27 15.31 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 123.209 0.604 . . . . 10.0 112.144 -176.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -141.62 123.38 15.22 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 108.636 -0.876 . . . . 10.0 108.636 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -54.1 -36.1 62.84 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 124.134 0.974 . . . . 10.0 112.679 172.333 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -59.04 -47.41 85.34 Favored 'General case' 0 C--N 1.34 0.17 0 N-CA-C 110.426 -0.212 . . . . 10.0 110.426 170.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.78 -34.33 76.58 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.743 -0.598 . . . . 10.0 110.621 -178.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.411 HD11 ' HA ' ' A' ' -1' ' ' LEU . 33.8 mt -64.37 -51.61 66.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 N-CA-C 108.428 -0.952 . . . . 10.0 108.428 178.243 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.492 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -69.29 -42.3 75.66 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 117.695 -1.602 . . . . 10.0 112.294 -179.757 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -68.86 -22.48 64.2 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.641 1.576 . . . . 10.0 112.752 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -94.78 -28.8 15.09 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.95 0.722 . . . . 10.0 112.95 170.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.512 ' O ' HMC3 ' A' ' 90' ' ' HEC . . . -108.11 -64.94 1.16 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.052 0.941 . . . . 10.0 112.562 -171.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.42 44.16 0.34 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.742 1.217 . . . . 10.0 110.483 179.278 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.5 t -129.8 -6.32 4.55 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 124.883 1.273 . . . . 10.0 113.794 -164.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.6 t -97.11 -46.74 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 124.779 1.231 . . . . 10.0 108.236 -176.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 82.3 m -92.07 -63.68 1.21 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 127.582 2.353 . . . . 10.0 110.507 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -73.61 -20.92 60.46 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.961 1.097 . . . . 10.0 113.961 -167.448 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.8 t -57.82 -53.59 56.46 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.505 1.122 . . . . 10.0 111.394 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.0 tpt -108.91 -12.78 14.84 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.768 0.827 . . . . 10.0 112.422 -178.101 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.42 40.84 7.64 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.266 0.936 . . . . 10.0 112.264 -175.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 68.8 t -80.08 155.91 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.469 1.108 . . . . 10.0 109.149 176.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 55.6 21.63 4.65 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.772 1.229 . . . . 10.0 113.619 -176.322 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.87 20.52 76.02 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 124.231 0.919 . . . . 10.0 113.842 -176.473 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.83 141.77 79.22 Favored Pre-proline 0 CA--C 1.547 0.856 0 CA-C-N 118.64 1.22 . . . . 10.0 113.681 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.31 132.7 13.97 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 124.763 3.642 . . . . 10.0 111.815 -176.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -61.49 142.77 56.8 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.705 -1.247 . . . . 10.0 113.835 -161.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.0 m -50.83 -33.59 24.27 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.347 0.869 . . . . 10.0 113.347 176.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -125.63 117.61 23.9 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.248 1.019 . . . . 10.0 108.698 167.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -151.8 163.55 38.94 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.278 1.831 . . . . 10.0 106.838 172.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 96.5 m -110.08 -36.6 5.81 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.45 0.568 . . . . 10.0 111.138 170.267 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.95 -19.61 34.34 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.501 -0.749 . . . . 10.0 113.02 -175.562 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -83.09 -34.08 26.22 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.279 1.432 . . . . 10.0 110.283 178.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.431 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 63.7 m95 -82.24 -40.73 21.2 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.233 1.813 . . . . 10.0 111.624 176.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -39.49 -60.11 1.39 Allowed Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 114.496 1.295 . . . . 10.0 114.496 175.099 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -65.04 -8.3 17.87 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.389 2.726 . . . . 10.0 114.151 -177.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -95.77 -53.48 3.69 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.845 0.858 . . . . 10.0 110.152 170.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.47 -18.88 4.76 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.641 1.577 . . . . 10.0 113.394 178.073 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.63 -32.81 36.14 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.637 1.575 . . . . 10.0 109.993 -176.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.54 -46.65 12.18 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.876 -0.787 . . . . 10.0 108.876 174.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 163.88 -142.82 8.09 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 110.892 -0.883 . . . . 10.0 110.892 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.4 t -134.63 -56.27 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 122.707 1.241 . . . . 10.0 109.673 -174.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.67 -29.86 28.76 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 127.167 2.187 . . . . 10.0 111.232 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.547 ' ND2' ' H ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -55.92 -20.12 14.8 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.421 1.888 . . . . 10.0 113.916 175.3 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -103.13 -43.53 5.45 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.844 0.858 . . . . 10.0 111.061 -175.184 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 p -53.69 -34.07 23.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 118.119 0.418 . . . . 10.0 111.185 171.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -59.29 -48.55 81.21 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.099 1.148 . . . . 10.0 114.099 167.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.9 m -62.86 -35.14 79.0 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 120.617 -1.302 . . . . 10.0 110.152 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 28.5 t -58.04 -54.18 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.055 173.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.5 ptmt -61.83 -33.74 74.7 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.573 0.582 . . . . 10.0 112.573 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 97.6 m -72.01 -33.54 68.14 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.48 0.712 . . . . 10.0 112.37 -178.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.54 98.34 0.42 Allowed Glycine 0 CA--C 1.531 1.08 0 CA-C-N 118.809 0.731 . . . . 10.0 111.929 -173.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 5.0 tp -67.48 170.13 8.01 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.279 1.031 . . . . 10.0 111.106 174.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -52.68 -57.65 9.38 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.736 -1.228 . . . . 10.0 112.365 -171.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.32 20.9 9.74 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.33 1.452 . . . . 10.0 112.383 172.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 40.3 ttp -125.6 125.34 25.01 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 114.001 1.112 . . . . 10.0 114.001 172.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -61.87 151.22 82.44 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.868 1.712 . . . . 10.0 111.925 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -61.57 140.15 85.36 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 123.171 2.58 . . . . 10.0 110.677 -177.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.75 30.76 73.43 Favored Glycine 0 CA--C 1.53 1.008 0 CA-C-N 116.502 -0.317 . . . . 10.0 112.734 -170.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.51 36.27 5.93 Favored Glycine 0 CA--C 1.536 1.396 0 O-C-N 121.693 -0.886 . . . . 10.0 114.314 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.2 ttt 84.93 12.41 0.26 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.936 2.094 . . . . 10.0 114.685 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.7 m -106.35 167.52 9.78 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.594 1.158 . . . . 10.0 112.338 171.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.1 m -131.19 -49.48 1.01 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.882 1.673 . . . . 10.0 110.167 171.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -79.43 -29.77 42.02 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.414 1.486 . . . . 10.0 112.693 -175.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 21.9 m -55.21 122.29 10.73 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.108 1.763 . . . . 10.0 111.197 179.25 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.0 m -103.0 162.22 13.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.55 1.94 . . . . 10.0 109.539 -176.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -44.98 -44.77 10.14 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.788 -1.195 . . . . 10.0 113.627 176.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -50.0 -40.11 43.34 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.838 0.855 . . . . 10.0 112.248 174.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.402 ' HB3' ' CD1' ' A' ' 6' ' ' ILE . 0.4 OUTLIER -84.46 -44.08 14.0 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.619 0.767 . . . . 10.0 111.154 178.239 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -58.03 -50.2 74.23 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.895 -1.128 . . . . 10.0 112.285 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -58.41 -46.52 86.29 Favored 'General case' 0 N--CA 1.463 0.216 0 O-C-N 121.783 -0.573 . . . . 10.0 110.027 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.5 -34.34 64.52 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 121.923 0.868 . . . . 10.0 112.858 170.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.34 -41.28 63.65 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 120.222 -1.549 . . . . 10.0 111.456 -178.078 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.2 pt -75.69 -33.13 25.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 O-C-N 121.646 -0.659 . . . . 10.0 112.634 175.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -69.86 -32.69 71.2 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.566 -0.709 . . . . 10.0 111.206 174.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -48.51 -48.34 38.22 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 119.092 0.86 . . . . 10.0 111.167 172.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.413 ' HB3' ' CZ2' ' A' ' 31' ' ' TRP . 73.3 mtm -71.76 -51.82 20.76 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.748 -0.66 . . . . 10.0 112.152 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -154.15 -79.29 0.1 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 117.595 0.18 . . . . 10.0 111.317 173.318 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 161.48 47.05 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.595 2.758 . . . . 10.0 110.68 -176.16 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.2 -88.58 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.478 0.918 . . . . 10.0 113.478 175.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.431 ' HE2' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.136 0 N-CA-C 115.205 1.557 . . . . 10.0 115.205 -172.061 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.836 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 118.27 -0.871 . . . . 10.0 109.533 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -159.89 126.53 4.4 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 108.815 -0.809 . . . . 10.0 108.815 -149.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -1' ' ' LEU . . . . . 0.54 ' HA ' HD11 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -74.54 57.64 0.73 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.761 0.824 . . . . 10.0 113.06 -175.072 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.26 -21.49 14.33 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 114.036 1.125 . . . . 10.0 114.036 -170.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.45 ' O ' HD13 ' A' ' 6' ' ' ILE . 47.4 t0 -143.5 -164.2 1.81 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.775 2.03 . . . . 10.0 107.193 -174.034 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.75 -44.26 4.07 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 127.29 2.236 . . . . 10.0 111.664 172.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -58.84 -48.35 81.65 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.941 -0.474 . . . . 10.0 111.649 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.44 -28.61 68.74 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.336 -0.852 . . . . 10.0 110.96 -177.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.54 HD11 ' HA ' ' A' ' -1' ' ' LEU . 1.4 mp -69.24 -51.65 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.128 -1.064 . . . . 10.0 108.128 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.431 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.4 OUTLIER -68.34 -41.95 79.99 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 118.026 -1.47 . . . . 10.0 111.747 177.093 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -67.97 -22.11 65.04 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.956 1.702 . . . . 10.0 112.778 -176.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.58 -28.42 16.04 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.838 1.051 . . . . 10.0 113.838 167.383 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.444 ' O ' HMC3 ' A' ' 90' ' ' HEC . . . -105.73 -67.77 0.91 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.131 0.972 . . . . 10.0 112.057 -171.051 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.431 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.04 41.86 0.3 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 125.251 1.42 . . . . 10.0 110.365 -179.029 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -128.46 -7.11 5.23 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 125.657 1.583 . . . . 10.0 113.283 -167.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.2 t -94.52 -39.97 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.134 0.973 . . . . 10.0 108.54 -176.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.7 m -106.93 -55.71 2.29 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.779 1.632 . . . . 10.0 110.629 -172.055 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' HIS . . . . . 0.445 ' CE1' ' HG2' ' A' ' 23' ' ' PRO . 20.0 m-70 -75.19 -19.67 59.69 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.665 1.357 . . . . 10.0 114.665 -172.482 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m -65.45 -51.64 58.76 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.464 0.705 . . . . 10.0 110.237 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.71 -34.59 10.47 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.092 1.357 . . . . 10.0 111.595 -177.259 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.09 57.74 1.0 Allowed Glycine 0 CA--C 1.537 1.451 0 C-N-CA 126.296 1.903 . . . . 10.0 112.508 -174.161 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 18.5 t -94.9 153.68 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 124.769 1.227 . . . . 10.0 110.435 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.09 20.84 5.85 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.241 1.416 . . . . 10.0 113.528 -177.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.9 22.31 69.27 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.561 1.077 . . . . 10.0 113.571 -173.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.69 143.14 94.69 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 118.516 1.158 . . . . 10.0 112.606 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.445 ' HG2' ' CE1' ' A' ' 15' ' ' HIS . 96.4 Cg_endo -74.22 146.99 36.93 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 124.776 3.651 . . . . 10.0 110.571 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -74.54 135.45 42.15 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.812 -0.555 . . . . 10.0 111.657 -167.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.66 -34.12 4.81 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.651 1.18 . . . . 10.0 113.472 178.109 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 48.8 p-80 -125.32 103.57 8.0 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.803 1.641 . . . . 10.0 108.971 170.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -141.24 161.8 37.02 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 107.182 -1.414 . . . . 10.0 107.182 170.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 59.7 m -109.94 -35.6 6.1 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.408 0.549 . . . . 10.0 111.35 171.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.48 -12.65 45.38 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.295 -0.878 . . . . 10.0 113.293 -177.173 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.446 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 13.7 t0 -88.58 -25.77 22.31 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.641 1.576 . . . . 10.0 109.898 174.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.467 ' CZ3' ' OXT' ' A' ' 78' ' ' LYS . 63.4 m95 -96.68 -35.06 11.15 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.719 1.608 . . . . 10.0 111.095 -179.368 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.07 -52.64 19.14 Favored Pre-proline 0 CA--C 1.549 0.941 0 N-CA-C 114.694 1.368 . . . . 10.0 114.694 169.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -74.83 16.18 0.66 Allowed 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.933 2.422 . . . . 10.0 113.641 -179.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 -122.07 -45.05 2.26 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.78 2.032 . . . . 10.0 108.827 176.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.519 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -59.41 0.96 0.09 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.054 1.742 . . . . 10.0 114.433 166.877 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -81.11 -27.08 35.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.98 1.312 . . . . 10.0 109.842 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -90.42 -57.08 2.96 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.4 0.68 . . . . 10.0 110.492 173.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 148.9 -115.69 0.75 Allowed Glycine 0 CA--C 1.531 1.083 0 C-N-CA 123.845 0.736 . . . . 10.0 111.279 174.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.52 173.79 13.47 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.163 0 C-N-CA 125.064 1.346 . . . . 10.0 110.893 171.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.258 16.0 m-20 69.3 -27.51 0.16 Allowed 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 125.48 1.512 . . . . 10.0 112.877 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.67 -26.86 68.86 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.014 -1.678 . . . . 10.0 113.859 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -99.55 -38.51 8.73 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.623 0.769 . . . . 10.0 111.07 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -54.52 -33.99 27.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 122.015 -0.428 . . . . 10.0 110.25 172.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 ptmt -59.11 -46.97 86.96 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.916 1.08 . . . . 10.0 113.916 169.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 55.5 m -68.53 -28.38 66.93 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 120.59 -1.319 . . . . 10.0 110.547 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.3 t -60.24 -54.06 40.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 O-C-N 121.657 -0.652 . . . . 10.0 111.481 170.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -33.84 73.5 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 111.951 0.352 . . . . 10.0 111.951 177.327 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.03 -35.39 66.76 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.514 0.561 . . . . 10.0 112.514 -178.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.74 112.67 0.21 Allowed Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.255 -0.738 . . . . 10.0 111.255 -167.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.6 -155.23 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.578 0.751 . . . . 10.0 110.523 170.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -73.13 -66.58 0.66 Allowed 'General case' 0 N--CA 1.475 0.802 0 O-C-N 119.67 -1.894 . . . . 10.0 111.608 -173.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.31 -16.51 61.37 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.508 1.123 . . . . 10.0 112.118 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.2 ttp -100.77 118.05 61.45 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 123.237 0.615 . . . . 10.0 111.826 -172.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.02 154.3 70.92 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.115 1.876 . . . . 10.0 111.926 -173.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -59.58 124.8 16.22 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 123.991 3.127 . . . . 10.0 110.973 -177.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.89 43.03 8.49 Favored Glycine 0 C--N 1.34 0.793 0 CA-C-O 118.954 -0.914 . . . . 10.0 111.249 -172.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 17.6 57.73 0.01 OUTLIER Glycine 0 CA--C 1.531 1.088 0 C-N-CA 126.976 2.227 . . . . 10.0 115.422 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.656 ' HB2' HMC2 ' A' ' 90' ' ' HEC . 0.0 OUTLIER 72.34 -51.98 0.7 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.003 1.321 . . . . 10.0 112.972 -172.759 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.6 p -79.63 87.57 5.18 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 173.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 68.3 p -55.79 -50.07 71.47 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.399 -0.813 . . . . 10.0 111.124 171.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -78.32 63.24 3.16 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.824 1.65 . . . . 10.0 110.166 178.72 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 2.9 m -131.12 122.84 27.38 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.863 1.265 . . . . 10.0 111.073 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.0 m -90.83 141.72 28.52 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 124.765 1.226 . . . . 10.0 109.368 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -43.07 -38.18 2.25 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.32 1.23 . . . . 10.0 114.32 177.315 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -47.81 -58.52 4.25 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.225 1.01 . . . . 10.0 112.417 169.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -74.52 -40.87 61.48 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.901 1.281 . . . . 10.0 110.168 -178.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -57.09 14.08 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.024 0.929 . . . . 10.0 109.811 178.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -51.53 68.28 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.688 1.195 . . . . 10.0 110.036 -177.203 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.4 -33.76 55.08 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.354 -0.841 . . . . 10.0 112.709 170.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.58 -31.73 47.35 Favored 'General case' 0 C--N 1.341 0.222 0 O-C-N 121.013 -1.055 . . . . 10.0 111.487 -175.235 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.489 HG12 ' OXT' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -78.81 -50.42 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-O 121.775 0.797 . . . . 10.0 109.471 173.953 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -53.68 -31.71 48.88 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.203 1.401 . . . . 10.0 112.17 176.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -49.82 -58.08 6.09 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 124.568 1.147 . . . . 10.0 112.197 172.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.431 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 4.9 mpp? -64.17 -57.05 10.68 Favored 'General case' 0 C--N 1.34 0.194 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 177.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -177.09 129.45 0.17 Allowed 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.519 -1.289 . . . . 10.0 107.519 174.073 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.02 74.16 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.587 1.955 . . . . 10.0 113.185 172.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.519 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -163.99 -65.4 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.484 1.514 . . . . 10.0 113.757 -171.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.489 ' OXT' HG12 ' A' ' 71' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.712 0 N-CA-C 116.006 1.854 . . . . 10.0 116.006 -165.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.9 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.202 0 CA-C-O 120.486 0.184 . . . . 10.0 111.289 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -168.88 126.28 1.0 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.155 0.982 . . . . 10.0 108.645 -167.162 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -77.81 68.01 3.79 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.766 0.793 . . . . 10.0 110.218 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -113.52 -22.38 10.35 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.216 1.406 . . . . 10.0 114.123 176.339 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -146.97 117.37 7.43 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 -177.317 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -45.2 -40.58 7.41 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.529 1.131 . . . . 10.0 113.743 173.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -60.48 -49.64 76.74 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.356 -0.215 . . . . 10.0 110.667 172.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.55 -30.69 70.4 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.557 -0.715 . . . . 10.0 111.303 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 15.8 mt -66.73 -52.79 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.437 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.3 OUTLIER -68.56 -40.92 80.43 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 117.921 -1.511 . . . . 10.0 111.16 -179.372 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -69.04 -21.95 64.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.041 1.737 . . . . 10.0 113.273 -178.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.14 -29.08 15.33 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 121.21 -0.931 . . . . 10.0 113.172 168.599 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.72 -66.72 1.01 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.356 1.062 . . . . 10.0 112.78 -171.162 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.437 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.04 39.64 0.19 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.116 1.366 . . . . 10.0 110.757 179.169 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -125.12 3.37 7.92 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.797 1.239 . . . . 10.0 113.62 -167.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.3 t -105.84 -52.55 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 124.71 1.204 . . . . 10.0 108.249 -174.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.5 m -84.49 -62.53 1.53 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.559 1.544 . . . . 10.0 111.08 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 72.4 m-70 -73.92 -23.87 59.6 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.943 1.46 . . . . 10.0 114.943 -167.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.42 -46.78 87.76 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.152 0.581 . . . . 10.0 110.456 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -109.51 -22.21 12.1 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.847 0.859 . . . . 10.0 111.871 -176.481 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.46 57.34 1.88 Allowed Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.032 0.825 . . . . 10.0 112.019 -175.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 46.4 t -103.34 161.24 4.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 125.375 1.47 . . . . 10.0 109.396 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.33 22.05 10.38 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.089 0.956 . . . . 10.0 113.163 -175.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 73.69 16.4 79.17 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 124.157 0.884 . . . . 10.0 113.199 -173.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.15 144.18 98.15 Favored Pre-proline 0 CA--C 1.543 0.699 0 CA-C-N 118.262 1.031 . . . . 10.0 113.366 -174.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -76.28 139.1 20.75 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 124.249 3.299 . . . . 10.0 111.015 -176.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 mttt -62.54 143.81 56.79 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.524 0.564 . . . . 10.0 112.524 -165.184 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t -49.14 -35.29 16.19 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.436 1.094 . . . . 10.0 113.511 177.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -142.01 57.78 1.48 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.829 0.852 . . . . 10.0 112.277 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -79.35 165.46 23.11 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 165.317 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.2 p -107.95 -35.91 6.5 Favored 'General case' 0 C--O 1.222 -0.377 0 O-C-N 121.67 -0.643 . . . . 10.0 111.417 164.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.06 -22.01 56.13 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 120.557 -1.34 . . . . 10.0 113.203 -176.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -87.78 -23.4 24.08 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.396 2.278 . . . . 10.0 110.259 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.537 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 43.7 m95 -97.28 -36.8 10.29 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.053 1.741 . . . . 10.0 110.776 178.6 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -41.64 -59.79 2.26 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.27 1.428 . . . . 10.0 114.037 174.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -64.04 -10.87 24.75 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 122.613 2.209 . . . . 10.0 113.833 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -96.43 -47.77 5.84 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.506 1.122 . . . . 10.0 110.084 176.402 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -17.58 64.75 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.442 1.897 . . . . 10.0 112.407 179.577 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -82.36 -38.05 24.77 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 125.026 1.33 . . . . 10.0 109.097 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt -68.01 -49.76 59.61 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.534 171.211 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 162.59 -132.9 2.91 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 112.142 -0.383 . . . . 10.0 112.142 178.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.3 t -137.86 -54.02 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 C-N-CA 123.875 0.87 . . . . 10.0 109.975 179.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -74.38 34.5 0.09 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.456 1.502 . . . . 10.0 113.251 -177.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.512 ' HB2' HD22 ' A' ' 42' ' ' LEU . 1.2 m120 -111.08 -54.74 2.57 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.762 2.425 . . . . 10.0 106.27 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.512 HD22 ' HB2' ' A' ' 41' ' ' ASN . 4.0 mm? -77.15 -32.52 56.35 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.481 -0.762 . . . . 10.0 110.552 -175.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.95 -15.3 16.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 O-C-N 121.929 -0.482 . . . . 10.0 111.566 171.707 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -85.96 -49.11 8.1 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.421 0.688 . . . . 10.0 111.102 168.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.8 m -58.59 -38.87 78.86 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 120.428 1.467 . . . . 10.0 110.64 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.7 p -62.0 -42.94 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-O 121.425 0.631 . . . . 10.0 110.963 -178.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.8 -30.42 51.23 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.762 0.825 . . . . 10.0 111.922 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 53.4 m -74.63 -25.45 59.23 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.438 1.095 . . . . 10.0 112.618 176.336 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.97 115.16 0.34 Allowed Glycine 0 CA--C 1.529 0.912 0 CA-C-N 119.486 1.039 . . . . 10.0 111.99 -175.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.3 tp -105.77 -145.74 0.38 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.518 0.727 . . . . 10.0 111.008 177.336 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -80.27 141.66 35.32 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 122.566 1.175 . . . . 10.0 108.768 174.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 55.72 22.09 5.16 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 112.183 -2.281 . . . . 10.0 111.953 173.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.6 ttp -144.64 123.3 6.84 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.516 1.127 . . . . 10.0 110.571 -174.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.45 148.39 48.29 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 121.881 1.721 . . . . 10.0 112.038 -173.147 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -62.95 113.66 2.1 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 123.648 2.899 . . . . 10.0 110.189 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 114.7 -10.6 21.31 Favored Glycine 0 CA--C 1.529 0.929 0 O-C-N 123.566 0.541 . . . . 10.0 112.668 -170.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.07 49.48 78.03 Favored Glycine 0 CA--C 1.534 1.234 0 O-C-N 120.429 -1.63 . . . . 10.0 109.999 -175.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 76.39 -45.54 0.51 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.462 1.905 . . . . 10.0 112.812 -177.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.0 p -76.86 159.57 29.94 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.215 -0.928 . . . . 10.0 111.279 177.568 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 34.1 p -110.05 -69.43 0.86 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.315 1.046 . . . . 10.0 110.38 -177.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -78.87 54.68 1.6 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.882 1.273 . . . . 10.0 110.602 -179.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -86.22 115.83 24.03 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.443 1.097 . . . . 10.0 111.086 -176.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 50.0 m -91.69 126.94 36.95 Favored 'General case' 0 C--O 1.231 0.09 0 N-CA-C 108.568 -0.901 . . . . 10.0 108.568 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -43.96 -34.4 1.68 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.299 1.439 . . . . 10.0 113.174 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -43.81 -66.78 0.34 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.464 1.105 . . . . 10.0 113.275 163.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.67 -29.24 62.2 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.329 -0.857 . . . . 10.0 110.081 -177.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.03 -52.62 64.19 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.807 0.813 . . . . 10.0 111.358 179.232 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -66.69 -47.1 73.49 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-O 117.804 -1.093 . . . . 10.0 109.296 176.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.15 -29.67 5.74 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 120.097 1.317 . . . . 10.0 113.524 171.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.24 -36.61 22.59 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.397 1.079 . . . . 10.0 112.131 -177.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.0 mt -81.63 -47.55 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.86 1.264 . . . . 10.0 111.8 176.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.25 -34.7 33.61 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.336 1.454 . . . . 10.0 112.443 172.77 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -44.24 -39.71 4.64 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.785 0.834 . . . . 10.0 112.523 173.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.537 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -82.5 -70.43 0.55 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 122.771 0.428 . . . . 10.0 111.962 -178.456 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 t -161.34 32.48 0.14 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.674 0.79 . . . . 10.0 112.488 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.8 pttt 36.94 57.74 1.17 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.457 1.503 . . . . 10.0 114.588 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.05 -52.65 0.37 Allowed 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 113.841 1.052 . . . . 10.0 113.841 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.407 ' O ' ' NZ ' ' A' ' 78' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.911 0 C-N-CA 125.165 1.386 . . . . 10.0 113.443 -166.732 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.705 HMC1 ' CBC' ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.998 0 N-CA-C 108.097 -1.075 . . . . 10.0 108.097 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -163.46 126.54 2.67 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.261 -1.015 . . . . 10.0 108.261 176.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' -1' ' ' LEU . . . . . 0.413 ' HA ' HD11 ' A' ' 6' ' ' ILE . 1.2 tm? -74.62 68.94 1.7 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 122.046 0.927 . . . . 10.0 110.516 176.726 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -114.48 -20.2 10.87 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.452 1.501 . . . . 10.0 114.165 -178.234 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 3' ' ' ALA . 15.6 t70 -144.47 -153.39 0.47 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.958 1.303 . . . . 10.0 108.321 -174.184 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.407 ' H ' ' CG ' ' A' ' 2' ' ' ASP . . . -127.82 -40.4 1.72 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 128.335 2.654 . . . . 10.0 111.443 177.148 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -56.49 -46.69 80.35 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.449 0.642 . . . . 10.0 110.47 175.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.96 -31.52 72.15 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.877 -0.514 . . . . 10.0 110.746 -178.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.413 HD11 ' HA ' ' A' ' -1' ' ' LEU . 1.3 mp -69.3 -52.34 34.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 N-CA-C 107.983 -1.117 . . . . 10.0 107.983 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.485 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -68.27 -39.47 82.15 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 118.181 -1.408 . . . . 10.0 111.325 -179.148 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -69.39 -22.83 63.68 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.204 1.402 . . . . 10.0 113.003 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.64 -30.98 16.04 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.667 0.988 . . . . 10.0 113.667 167.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.426 ' O ' HMC3 ' A' ' 90' ' ' HEC . . . -110.01 -64.89 1.21 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.24 1.016 . . . . 10.0 111.946 -166.595 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.485 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.74 41.2 0.2 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.627 1.171 . . . . 10.0 110.912 177.43 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -128.81 0.25 5.39 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 125.66 1.584 . . . . 10.0 113.631 -166.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.5 t -101.97 -51.11 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 124.62 1.168 . . . . 10.0 108.199 -176.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.6 m -88.67 -64.1 1.2 Allowed 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.119 1.768 . . . . 10.0 109.933 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.3 m-70 -73.65 -11.19 60.34 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.05 1.5 . . . . 10.0 115.05 -166.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.35 -36.68 63.62 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.124 0.97 . . . . 10.0 110.908 178.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -125.23 -37.42 2.4 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.753 1.221 . . . . 10.0 112.24 -172.419 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.35 64.15 1.17 Allowed Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.75 1.643 . . . . 10.0 112.909 175.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 73.5 t -84.67 -56.66 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 123.657 0.783 . . . . 10.0 111.925 -176.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.1 33.23 0.44 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.941 0.897 . . . . 10.0 111.128 177.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 63.59 21.8 65.25 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 124.497 1.046 . . . . 10.0 113.258 -174.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.97 137.95 97.14 Favored Pre-proline 0 CA--C 1.545 0.756 0 O-C-N 121.813 -0.816 . . . . 10.0 112.564 -174.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -70.08 135.55 29.96 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.645 2.897 . . . . 10.0 110.3 -175.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.5 mtmm -53.58 133.62 41.26 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.155 -0.966 . . . . 10.0 112.578 -171.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.4 p -55.68 -14.16 2.07 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.824 1.046 . . . . 10.0 113.824 173.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -145.82 45.65 1.27 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.436 1.094 . . . . 10.0 111.848 177.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.424 ' HB3' ' HB2' ' A' ' 30' ' ' ASP . 1.3 t-20 -76.64 167.95 20.94 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.407 -0.808 . . . . 10.0 109.82 166.492 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.7 t -109.15 -35.65 6.25 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.875 -0.516 . . . . 10.0 111.53 161.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.83 -21.14 51.94 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.181 -1.574 . . . . 10.0 113.345 -174.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.424 ' HB2' ' HB3' ' A' ' 27' ' ' ASN . 0.5 OUTLIER -82.77 -26.69 31.63 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.08 2.152 . . . . 10.0 110.006 177.063 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.493 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 41.0 m95 -94.5 -36.34 11.9 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.841 1.656 . . . . 10.0 110.846 -177.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -45.33 -56.78 8.66 Favored Pre-proline 0 CA--C 1.545 0.778 0 O-C-N 120.811 -1.181 . . . . 10.0 113.635 174.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -76.47 21.57 0.55 Allowed 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.167 2.578 . . . . 10.0 113.133 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.423 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 1.8 mmp_? -125.37 -47.98 1.71 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.582 1.953 . . . . 10.0 109.02 175.733 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -19.66 47.14 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.799 2.44 . . . . 10.0 112.036 173.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.41 -28.45 37.81 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 124.526 1.131 . . . . 10.0 110.124 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.6 mmmt -74.93 -51.26 14.23 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 174.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 158.3 -117.34 0.77 Allowed Glycine 0 CA--C 1.531 1.06 0 C-N-CA 124.686 1.136 . . . . 10.0 110.403 177.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.01 -56.64 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 124.294 1.038 . . . . 10.0 110.764 177.606 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.49 17.17 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.486 1.115 . . . . 10.0 113.371 -176.812 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -97.89 -22.97 16.04 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 125.754 1.621 . . . . 10.0 110.526 177.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -104.43 -43.14 5.26 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.338 1.055 . . . . 10.0 110.031 -175.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -54.36 -33.22 25.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 O-C-N 121.72 -0.613 . . . . 10.0 111.151 171.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -63.68 -43.45 96.63 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.217 -0.927 . . . . 10.0 113.112 172.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.7 m -66.16 -34.15 77.4 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.203 -0.935 . . . . 10.0 110.371 177.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.414 ' HA ' ' HE3' ' A' ' 53' ' ' MET . 31.3 t -56.87 -54.86 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 122.491 0.317 . . . . 10.0 110.995 174.493 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -35.08 68.91 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.952 0.723 . . . . 10.0 112.952 175.785 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 22.6 m -71.58 -36.13 70.78 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.05 0.54 . . . . 10.0 111.999 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.48 95.68 0.6 Allowed Glycine 0 CA--C 1.528 0.904 0 CA-C-N 118.862 0.756 . . . . 10.0 111.23 -174.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.1 tp -60.13 169.39 1.58 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 122.138 0.971 . . . . 10.0 111.839 173.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -50.32 -55.95 13.35 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.71 -1.244 . . . . 10.0 112.603 -174.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -95.29 20.39 9.36 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 113.799 -1.546 . . . . 10.0 112.073 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.414 ' HE3' ' HA ' ' A' ' 46' ' ' VAL . 39.7 ttp -129.08 130.63 23.42 Favored Pre-proline 0 CA--C 1.551 1.019 0 N-CA-C 114.478 1.288 . . . . 10.0 114.478 175.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -64.02 157.43 53.1 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 121.992 1.794 . . . . 10.0 112.182 177.497 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -60.12 137.0 72.66 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.791 2.327 . . . . 10.0 110.118 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 62.16 27.9 69.8 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-O 118.927 -0.93 . . . . 10.0 113.756 -175.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 48.21 33.85 11.63 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.128 1.347 . . . . 10.0 113.782 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 71.15 45.58 0.49 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.973 1.309 . . . . 10.0 112.077 -175.506 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.8 t -125.5 -52.6 1.6 Allowed 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.592 -0.693 . . . . 10.0 111.669 163.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.9 m 70.2 -69.47 0.17 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.993 1.317 . . . . 10.0 110.818 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -84.16 55.06 3.17 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.878 0.871 . . . . 10.0 110.699 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.3 m -114.65 140.56 48.73 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.354 1.462 . . . . 10.0 109.644 173.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 59.9 m -101.78 146.55 27.62 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.525 1.13 . . . . 10.0 109.492 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -41.92 -39.84 1.97 Allowed 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 115.063 1.505 . . . . 10.0 115.063 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -42.71 -63.59 0.76 Allowed 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.758 1.163 . . . . 10.0 112.607 167.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.82 -40.05 63.62 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.541 1.936 . . . . 10.0 109.613 -175.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -59.12 5.83 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.923 0.889 . . . . 10.0 110.065 178.02 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt -59.16 -46.29 88.77 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.525 1.13 . . . . 10.0 109.411 178.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.01 -26.48 37.28 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.3 -0.875 . . . . 10.0 112.415 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.85 -6.64 57.2 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 125.212 1.405 . . . . 10.0 112.648 -174.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.51 -40.27 4.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 125.447 1.499 . . . . 10.0 110.335 167.482 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.81 -40.71 76.47 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.71 0.804 . . . . 10.0 111.108 175.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -52.64 -36.8 57.34 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.893 0.701 . . . . 10.0 112.893 176.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.493 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 2.6 mpp? -75.3 -66.03 0.82 Allowed 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 121.819 -0.55 . . . . 10.0 111.562 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -166.53 35.37 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 119.569 -0.853 . . . . 10.0 112.519 -178.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt 37.29 51.65 1.13 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.861 0.864 . . . . 10.0 113.301 -176.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.423 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -141.3 -82.93 0.21 Allowed 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.012 1.116 . . . . 10.0 114.012 170.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.984 0 N-CA-C 115.733 1.753 . . . . 10.0 115.733 -164.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.811 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.128 0 N-CA-C 113.0 0.741 . . . . 10.0 113.0 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -166.71 122.7 1.19 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.187 -1.042 . . . . 10.0 108.187 -178.366 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.56 38.81 0.12 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.868 1.062 . . . . 10.0 113.868 -179.566 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -98.68 -26.23 14.44 Favored 'General case' 0 N--CA 1.461 0.11 0 O-C-N 121.298 -0.876 . . . . 10.0 113.081 -174.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -141.24 127.42 19.65 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.995 -1.113 . . . . 10.0 107.995 172.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.96 -36.99 75.75 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.965 0.906 . . . . 10.0 112.003 175.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -61.94 -48.41 80.53 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 120.401 -0.52 . . . . 10.0 110.934 172.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.08 -31.0 71.61 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 121.34 -0.85 . . . . 10.0 109.848 -177.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 mm -65.77 -52.78 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 117.698 -1.144 . . . . 10.0 109.248 173.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.406 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.5 OUTLIER -68.17 -39.55 82.52 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 121.258 1.844 . . . . 10.0 112.153 -178.541 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -69.74 -22.32 63.38 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.288 2.235 . . . . 10.0 111.926 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.89 -27.12 15.33 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.035 1.124 . . . . 10.0 114.035 166.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -104.98 -70.67 0.77 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.131 1.372 . . . . 10.0 112.557 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.406 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.49 42.07 0.27 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.937 1.695 . . . . 10.0 110.418 -178.775 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.0 t -127.48 -5.49 5.91 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 125.172 1.389 . . . . 10.0 113.677 -164.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 42.1 t -95.87 -53.5 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 CA-C-O 122.311 1.053 . . . . 10.0 108.167 -175.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 29.2 m -93.04 -55.24 3.41 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.525 1.53 . . . . 10.0 109.261 -171.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -72.76 -19.8 61.3 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.677 1.191 . . . . 10.0 113.334 -172.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.9 t -63.62 -49.6 72.67 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.18 0.592 . . . . 10.0 110.879 -178.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.7 tpt -112.08 -27.21 8.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.332 1.053 . . . . 10.0 112.977 -177.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.64 58.62 2.01 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 124.781 1.181 . . . . 10.0 112.859 -177.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 96.2 t -82.63 -58.22 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 121.898 -0.766 . . . . 10.0 112.204 -175.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.55 32.01 0.41 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.873 0.869 . . . . 10.0 111.044 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 63.62 23.91 67.44 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 123.747 0.689 . . . . 10.0 112.832 -172.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.94 145.15 97.71 Favored Pre-proline 0 CA--C 1.544 0.731 0 O-C-N 121.769 -0.842 . . . . 10.0 111.142 176.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.94 144.86 35.01 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.73 2.953 . . . . 10.0 110.873 -174.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -65.53 138.31 57.97 Favored 'General case' 0 C--O 1.239 0.534 0 O-C-N 121.796 -0.565 . . . . 10.0 111.897 -171.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.6 m -19.58 -51.26 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 128.189 2.596 . . . . 10.0 115.206 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -144.68 53.1 1.24 Allowed 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.999 0.428 . . . . 10.0 111.45 173.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -53.34 153.79 3.73 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.348 -0.845 . . . . 10.0 110.105 164.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 94.2 m -100.6 -35.56 9.46 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.203 -0.936 . . . . 10.0 111.001 169.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.09 -23.37 28.53 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 120.966 -1.084 . . . . 10.0 112.595 -171.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -81.71 -32.88 31.43 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.119 1.768 . . . . 10.0 109.768 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 43.6 m95 -85.08 -35.45 21.82 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.313 1.845 . . . . 10.0 111.459 178.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -42.64 -58.77 3.43 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 114.349 1.24 . . . . 10.0 114.349 174.553 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -73.27 15.58 0.5 Allowed 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 123.209 2.606 . . . . 10.0 113.743 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.03 -49.71 2.5 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.81 1.644 . . . . 10.0 108.95 173.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.9 mt -54.65 -12.01 0.68 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.407 1.483 . . . . 10.0 114.38 170.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.91 -37.16 16.69 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 125.117 1.367 . . . . 10.0 110.019 -173.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.0 mtpt -77.98 -47.07 19.37 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 166.63 -126.2 1.43 Allowed Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.892 -0.883 . . . . 10.0 110.892 173.373 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 86.5 t -138.62 -64.57 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 C-N-CA 123.399 0.68 . . . . 10.0 110.96 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.13 -35.7 59.99 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 119.065 -0.493 . . . . 10.0 111.373 -174.244 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -33.68 -42.22 0.11 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.742 1.217 . . . . 10.0 112.566 171.124 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -81.37 -42.6 20.25 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.744 1.218 . . . . 10.0 112.524 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -53.52 -33.95 22.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 O-C-N 121.078 -1.014 . . . . 10.0 110.981 169.128 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -44.31 96.98 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.394 -0.817 . . . . 10.0 112.622 169.594 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.6 m -61.47 -37.32 83.19 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 120.598 -1.314 . . . . 10.0 110.249 174.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 7.0 t -63.6 -55.1 24.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 122.866 0.466 . . . . 10.0 111.592 -178.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.03 -32.62 64.19 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 176.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.3 m -72.23 -30.0 64.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.936 0.895 . . . . 10.0 112.077 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 74.97 94.64 0.14 Allowed Glycine 0 CA--C 1.53 0.983 0 CA-C-N 118.98 0.809 . . . . 10.0 111.903 -176.355 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.2 tp -65.0 170.5 4.32 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.93 -0.747 . . . . 10.0 111.696 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -48.84 -58.19 5.21 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.612 -1.305 . . . . 10.0 112.946 -170.563 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.03 24.92 5.14 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.15 1.38 . . . . 10.0 112.768 173.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 35.3 ttp -132.01 127.19 21.0 Favored Pre-proline 0 CA--C 1.554 1.097 0 N-CA-C 114.5 1.296 . . . . 10.0 114.5 172.212 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.09 157.34 53.89 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 122.035 1.823 . . . . 10.0 112.937 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -64.78 129.92 24.74 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 123.663 2.908 . . . . 10.0 110.593 -175.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.02 25.46 74.67 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 121.575 -0.345 . . . . 10.0 112.429 -170.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.16 -46.3 2.7 Favored Glycine 0 CA--C 1.534 1.24 0 O-C-N 121.369 -1.077 . . . . 10.0 114.178 170.176 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -174.13 -48.27 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.387 2.275 . . . . 10.0 109.997 171.669 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.8 t -79.56 131.49 36.03 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.724 1.61 . . . . 10.0 110.9 177.374 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.5 m -89.54 -50.0 6.35 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 122.027 0.917 . . . . 10.0 110.212 173.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -78.88 60.6 2.9 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.725 2.41 . . . . 10.0 110.064 179.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 21.4 m -134.3 148.32 50.75 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.98 1.712 . . . . 10.0 110.615 174.118 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 59.4 m -108.93 155.78 20.45 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.639 1.576 . . . . 10.0 109.859 -178.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -46.17 -40.66 11.51 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.438 1.095 . . . . 10.0 112.99 177.326 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -57.12 -47.47 81.02 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.611 -0.68 . . . . 10.0 111.868 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.32 -44.07 63.22 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.812 -0.811 . . . . 10.0 108.812 -179.41 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -55.71 -49.95 71.63 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.266 0.555 . . . . 10.0 111.955 176.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -67.75 -52.55 36.07 Favored 'General case' 0 C--O 1.218 -0.603 0 CA-C-O 118.071 -0.966 . . . . 10.0 108.777 -176.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.39 -39.3 15.01 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.736 1.153 . . . . 10.0 112.859 171.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.05 -50.26 50.11 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.387 -0.821 . . . . 10.0 110.825 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 51.2 mt -58.31 -37.74 65.04 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.026 0 C-N-CA 125.498 1.519 . . . . 10.0 112.212 172.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -68.41 -38.22 81.05 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 126.778 2.031 . . . . 10.0 111.596 175.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -52.03 -36.18 49.35 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.538 0.57 . . . . 10.0 112.538 172.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 66.1 mtm -80.45 -71.97 0.43 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.777 0.831 . . . . 10.0 112.633 -179.12 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 7.0 t -162.96 45.59 0.13 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.742 -0.599 . . . . 10.0 111.78 172.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.2 ptpt 36.11 57.98 0.99 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.048 1.739 . . . . 10.0 114.948 176.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.21 -80.01 0.04 OUTLIER 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 112.425 0.528 . . . . 10.0 112.425 171.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.254 1.312 0 N-CA-C 116.005 1.854 . . . . 10.0 116.005 -169.083 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.868 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.386 0 N-CA-C 112.859 0.689 . . . . 10.0 112.859 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -161.25 98.66 1.16 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.569 1.548 . . . . 10.0 107.877 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' -1' ' ' LEU . . . . . 0.408 ' HA ' HD11 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -145.9 31.45 1.04 Allowed 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.361 1.064 . . . . 10.0 112.714 -176.372 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -97.72 -21.7 16.84 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 122.066 -0.396 . . . . 10.0 111.95 -171.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -143.85 125.22 14.72 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.775 1.23 . . . . 10.0 108.217 172.26 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -49.54 -39.24 33.84 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.36 1.064 . . . . 10.0 112.558 170.026 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -59.97 -45.06 93.92 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 122.365 -0.209 . . . . 10.0 111.175 171.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.6 -34.25 76.63 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.366 -0.834 . . . . 10.0 110.667 -179.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.408 HD11 ' HA ' ' A' ' -1' ' ' LEU . 35.6 mt -64.37 -52.75 51.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 N-CA-C 108.432 -0.951 . . . . 10.0 108.432 178.07 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.45 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.65 -39.83 76.85 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 117.962 -1.495 . . . . 10.0 111.998 -178.147 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -68.46 -22.6 64.56 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.118 1.367 . . . . 10.0 112.45 -177.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.65 -28.73 15.82 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.444 0.905 . . . . 10.0 113.444 170.318 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.467 ' O ' HMC3 ' A' ' 90' ' ' HEC . . . -109.03 -67.7 0.96 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.854 0.862 . . . . 10.0 112.373 -171.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.45 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.78 45.07 0.4 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 125.119 1.368 . . . . 10.0 110.159 -178.574 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.9 t -125.91 -15.13 5.98 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 120.495 -1.378 . . . . 10.0 113.859 -162.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.427 HG23 ' SG ' ' A' ' 14' ' ' CYS . 0.9 OUTLIER -95.02 -30.36 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.596 1.158 . . . . 10.0 109.1 -175.328 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.427 ' SG ' HG23 ' A' ' 13' ' ' VAL . 96.1 m -107.4 -64.12 1.23 Allowed 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 128.254 2.622 . . . . 10.0 109.624 -173.688 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -74.8 -19.38 60.22 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.929 1.085 . . . . 10.0 113.929 -168.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.8 t -61.88 -50.67 71.27 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.502 0.721 . . . . 10.0 110.891 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.6 mmt -109.15 -13.96 14.58 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.311 1.444 . . . . 10.0 112.731 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.91 45.6 7.59 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.43 1.014 . . . . 10.0 112.087 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 91.9 t -90.52 159.88 2.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 124.855 1.262 . . . . 10.0 109.512 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.11 19.0 5.66 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.677 1.191 . . . . 10.0 113.754 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.62 7.38 75.46 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.555 1.074 . . . . 10.0 113.804 -175.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.53 147.87 96.83 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 118.403 1.101 . . . . 10.0 113.234 -172.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -68.46 164.09 34.1 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 123.677 2.918 . . . . 10.0 110.351 174.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -84.76 142.68 29.64 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.523 -0.736 . . . . 10.0 111.919 -176.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -45.84 -28.06 1.0 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.449 1.5 . . . . 10.0 113.837 172.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -135.31 125.01 25.28 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.867 0.867 . . . . 10.0 109.282 164.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -155.03 157.86 38.25 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.374 1.87 . . . . 10.0 106.496 172.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 75.7 m -108.39 -36.41 6.25 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.728 0.695 . . . . 10.0 111.464 171.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.28 -29.55 53.87 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.379 -0.825 . . . . 10.0 112.205 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -75.98 -34.58 59.77 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.392 1.477 . . . . 10.0 110.177 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.459 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 58.9 m95 -84.7 -34.06 23.02 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.752 2.021 . . . . 10.0 112.024 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -39.01 -61.73 0.89 Allowed Pre-proline 0 CA--C 1.546 0.797 0 N-CA-C 114.719 1.377 . . . . 10.0 114.719 173.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.32 -16.62 52.49 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.766 2.311 . . . . 10.0 113.265 -177.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.4 mmt180 -87.5 -51.68 5.78 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.886 1.274 . . . . 10.0 109.269 -179.043 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.36 -17.53 30.72 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.509 1.524 . . . . 10.0 113.413 174.283 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.16 -38.6 12.05 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 125.479 1.511 . . . . 10.0 109.97 -173.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -62.25 -51.67 66.79 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.145 -0.48 . . . . 10.0 109.806 167.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.7 -129.85 2.24 Favored Glycine 0 CA--C 1.533 1.174 0 N-CA-C 111.092 -0.803 . . . . 10.0 111.092 176.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 5.2 t -134.05 -58.03 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 123.848 0.859 . . . . 10.0 109.663 179.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.87 19.09 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.891 1.676 . . . . 10.0 114.63 -175.991 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -97.4 -26.22 14.94 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 127.591 2.356 . . . . 10.0 110.189 174.708 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -94.58 -47.48 6.51 Favored 'General case' 0 N--CA 1.445 -0.675 0 C-N-CA 123.694 0.797 . . . . 10.0 109.736 -175.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.512 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.6 OUTLIER -51.93 -32.92 15.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.657 1.183 . . . . 10.0 112.29 173.041 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -71.38 -37.56 71.57 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 120.427 -1.42 . . . . 10.0 112.838 172.026 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.474 ' HA ' HG22 ' A' ' 48' ' ' THR . 2.6 t -75.87 -36.06 59.67 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.582 1.553 . . . . 10.0 110.996 -175.111 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.512 HG12 ' HA ' ' A' ' 43' ' ' VAL . 8.8 p -65.92 -48.27 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 O-C-N 121.408 -0.807 . . . . 10.0 110.852 168.488 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -34.51 76.13 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.954 -0.698 . . . . 10.0 111.266 -176.049 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.474 HG22 ' HA ' ' A' ' 45' ' ' SER . 1.2 t -74.95 -32.61 61.78 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.798 -0.564 . . . . 10.0 112.018 174.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.5 112.1 1.0 Allowed Glycine 0 CA--C 1.532 1.144 0 C-N-CA 123.904 0.764 . . . . 10.0 112.684 -173.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.61 -175.51 4.39 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.68 0.792 . . . . 10.0 110.835 169.51 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -55.02 -64.44 0.83 Allowed 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.308 -1.495 . . . . 10.0 113.706 -162.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.429 ' HB3' HMD2 ' A' ' 90' ' ' HEC . . . -79.52 8.1 6.98 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 115.598 -0.728 . . . . 10.0 112.5 173.148 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.19 138.91 19.68 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 114.113 1.153 . . . . 10.0 114.113 -175.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.38 140.42 52.76 Favored 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.094 1.862 . . . . 10.0 110.966 174.881 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -65.05 102.43 0.44 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.458 2.772 . . . . 10.0 109.649 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 110.35 12.37 17.54 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.342 0.496 . . . . 10.0 113.435 -175.07 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 56.15 34.75 62.91 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 118.663 1.232 . . . . 10.0 111.876 -177.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 73.59 -7.08 1.64 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.202 2.201 . . . . 10.0 114.074 -177.62 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.4 t -106.03 114.3 28.36 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.889 0.768 . . . . 10.0 112.113 -173.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 32.4 p -72.48 -53.4 12.22 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.321 1.048 . . . . 10.0 110.892 175.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -101.31 77.18 1.77 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.699 2.0 . . . . 10.0 109.024 177.428 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 12.0 m -123.87 132.63 53.79 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 121.572 -0.705 . . . . 10.0 110.844 161.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.8 p -79.25 163.27 25.09 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 122.159 -0.338 . . . . 10.0 110.198 171.053 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.98 -40.48 73.34 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.635 -0.666 . . . . 10.0 112.546 168.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.26 -51.83 63.31 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.728 0.695 . . . . 10.0 110.585 175.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -72.62 -36.6 68.11 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 122.23 -0.294 . . . . 10.0 111.34 -177.168 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -61.32 -52.17 65.81 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.749 -1.219 . . . . 10.0 111.334 173.16 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -63.37 -46.88 84.47 Favored 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 123.922 0.889 . . . . 10.0 109.823 -177.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.24 -40.86 49.01 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 121.323 0.582 . . . . 10.0 112.221 168.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.5 -39.82 70.57 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.865 -1.147 . . . . 10.0 112.051 -178.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.59 -55.49 19.58 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 124.078 0.951 . . . . 10.0 111.295 171.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -23.07 65.92 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 120.906 -1.121 . . . . 10.0 113.65 -177.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -43.69 -48.12 7.84 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.066 0.848 . . . . 10.0 111.364 168.087 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.459 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 3.6 mpp? -72.05 -50.02 31.86 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 112.228 0.455 . . . . 10.0 112.228 -179.249 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.84 -75.37 0.15 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.996 -0.526 . . . . 10.0 112.071 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 155.6 50.95 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 129.582 3.153 . . . . 10.0 111.589 -177.377 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -164.26 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.344 1.239 . . . . 10.0 114.344 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.437 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.27 0 N-CA-C 114.855 1.428 . . . . 10.0 114.855 -176.473 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.866 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 117.233 -1.365 . . . . 10.0 108.407 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -161.88 109.0 1.37 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.193 0.906 . . . . 10.0 110.375 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' -1' ' ' LEU . . . . . 0.593 HD13 ' HA ' ' A' ' 62' ' ' CYS . 1.7 tp -115.45 86.33 2.44 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.236 1.815 . . . . 10.0 109.62 -178.307 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -113.32 -20.29 11.42 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.906 1.817 . . . . 10.0 115.906 177.009 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.444 ' O ' HD13 ' A' ' 6' ' ' ILE . 14.5 t70 -147.53 -160.4 1.16 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.563 1.545 . . . . 10.0 107.664 -174.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -117.51 -40.2 3.08 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 128.609 2.764 . . . . 10.0 111.469 177.352 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.21 -46.85 82.53 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.239 0.542 . . . . 10.0 110.203 174.24 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.9 -29.33 69.19 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.72 -0.613 . . . . 10.0 110.91 -175.078 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.453 HD11 ' HA ' ' A' ' -1' ' ' LEU . 1.1 mp -67.92 -53.0 33.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 108.236 -1.024 . . . . 10.0 108.236 177.628 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.434 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.6 OUTLIER -68.44 -40.52 81.11 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 117.309 -1.756 . . . . 10.0 111.359 -178.762 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -69.61 -22.62 63.48 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.62 1.568 . . . . 10.0 113.164 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -96.38 -28.7 14.34 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.679 0.992 . . . . 10.0 113.679 170.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.47 -64.27 1.27 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.571 0.748 . . . . 10.0 112.011 -168.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.434 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.1 OUTLIER -73.92 29.13 0.08 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.591 1.157 . . . . 10.0 111.837 177.737 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -110.23 5.2 21.63 Favored 'General case' 0 CA--C 1.522 -0.124 0 O-C-N 120.583 -1.323 . . . . 10.0 113.984 -163.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 23.9 t -107.08 -44.4 7.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 125.048 1.339 . . . . 10.0 108.976 -172.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.7 m -95.85 -63.43 1.15 Allowed 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.92 2.088 . . . . 10.0 111.313 -177.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 35.9 m-70 -73.82 -23.26 59.63 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.606 0.965 . . . . 10.0 113.606 -167.155 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.1 t -58.47 -45.97 87.58 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.566 1.146 . . . . 10.0 111.041 -178.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 25.9 mmt -111.78 -20.55 12.03 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.983 1.313 . . . . 10.0 112.68 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.87 48.32 3.67 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 123.823 0.725 . . . . 10.0 112.16 -176.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 74.4 t -92.94 161.54 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 C-N-CA 125.107 1.363 . . . . 10.0 109.26 177.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.64 20.04 5.97 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.589 1.156 . . . . 10.0 113.328 -174.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 71.95 26.37 72.72 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.219 0.914 . . . . 10.0 113.293 -173.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.69 144.19 76.48 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 113.926 1.084 . . . . 10.0 113.926 -176.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -80.24 124.06 5.25 Favored 'Trans proline' 0 CA--C 1.537 0.646 1 C-N-CA 125.475 4.117 . . . . 10.0 111.759 -174.8 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -57.39 141.85 45.79 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 125.115 1.366 . . . . 10.0 112.485 -160.423 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.7 m -49.86 -56.94 8.52 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.532 0.568 . . . . 10.0 112.532 175.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -108.48 94.43 5.06 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 122.147 0.975 . . . . 10.0 111.098 178.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -135.72 166.5 23.13 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.226 1.41 . . . . 10.0 108.136 176.16 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.4 m -107.25 -38.59 5.93 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 118.259 0.482 . . . . 10.0 111.164 169.158 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.4 -16.15 47.02 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 120.868 -1.145 . . . . 10.0 113.22 -174.198 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -89.12 -23.49 22.47 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.199 1.8 . . . . 10.0 110.395 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 81.1 m95 -96.62 -36.0 10.87 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 126.443 1.897 . . . . 10.0 111.631 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -42.16 -58.64 3.28 Favored Pre-proline 0 CA--C 1.549 0.915 0 N-CA-C 114.436 1.272 . . . . 10.0 114.436 172.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.14 15.54 0.75 Allowed 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.517 2.812 . . . . 10.0 113.397 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.4 mmt85 -116.62 -45.42 2.8 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.555 1.542 . . . . 10.0 108.599 176.146 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.51 3.91 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.738 2.015 . . . . 10.0 114.916 165.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.02 -30.07 21.49 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.55 1.14 . . . . 10.0 110.289 177.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? -88.66 -56.04 3.46 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.902 0.481 . . . . 10.0 110.056 174.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.63 -122.33 1.11 Allowed Glycine 0 CA--C 1.531 1.089 0 C-N-CA 124.492 1.044 . . . . 10.0 110.526 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.5 -58.48 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 C-N-CA 124.181 0.992 . . . . 10.0 110.929 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.73 35.54 0.13 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.604 1.562 . . . . 10.0 113.369 -170.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -113.04 -57.65 2.26 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 128.017 2.527 . . . . 10.0 107.514 179.529 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mt -67.23 -29.5 69.16 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.916 1.286 . . . . 10.0 110.263 -175.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -55.69 -17.61 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 126.04 1.736 . . . . 10.0 113.743 168.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.9 mtmt -93.23 -43.38 8.85 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 172.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.457 ' HA ' HG22 ' A' ' 48' ' ' THR . 4.4 m -61.8 -32.3 72.58 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.121 0.962 . . . . 10.0 109.749 177.068 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.5 p -69.9 -38.52 75.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 170.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.4 -32.77 68.8 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.344 -0.848 . . . . 10.0 112.443 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.457 HG22 ' HA ' ' A' ' 45' ' ' SER . 10.1 t -75.47 -36.64 60.61 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.819 0.848 . . . . 10.0 113.211 173.684 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 82.77 117.66 0.56 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.607 -0.597 . . . . 10.0 111.607 -167.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.29 -150.87 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.268 0.627 . . . . 10.0 110.062 164.178 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -75.95 -67.23 0.7 Allowed 'General case' 0 N--CA 1.476 0.834 0 O-C-N 119.482 -2.011 . . . . 10.0 112.156 -172.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.68 -12.35 59.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.899 1.279 . . . . 10.0 111.919 174.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 mmm -78.24 129.31 75.62 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.151 0.58 . . . . 10.0 111.497 172.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.28 145.45 59.99 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 121.685 1.59 . . . . 10.0 110.071 176.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -61.59 130.06 30.2 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.656 2.237 . . . . 10.0 109.736 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.76 26.7 66.57 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 119.397 -1.382 . . . . 10.0 112.051 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 40.91 34.99 0.86 Allowed Glycine 0 CA--C 1.534 1.264 0 C-N-CA 126.123 1.821 . . . . 10.0 115.903 177.556 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.72 38.21 18.46 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.758 1.223 . . . . 10.0 112.868 -175.637 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -126.84 147.91 50.01 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.702 2.001 . . . . 10.0 109.666 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.7 m -116.15 -77.93 0.57 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.341 0.657 . . . . 10.0 110.245 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -79.1 46.3 0.69 Allowed 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.55 1.14 . . . . 10.0 111.055 -173.276 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.593 ' HA ' HD13 ' A' ' -1' ' ' LEU . 4.5 m -125.52 138.69 53.98 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.171 1.788 . . . . 10.0 110.918 -166.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 45.8 m -112.17 -103.33 0.4 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.979 0.809 . . . . 10.0 109.948 -171.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -139.74 -48.42 0.46 Allowed 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 124.568 1.147 . . . . 10.0 109.011 -178.004 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -43.84 -60.27 1.89 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 120.325 1.421 . . . . 10.0 113.854 175.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.549 ' HB2' HD11 ' A' ' -1' ' ' LEU . 50.2 m-20 -74.32 -29.93 61.83 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.596 0.712 . . . . 10.0 110.217 -178.745 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -44.85 95.67 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.226 -0.921 . . . . 10.0 113.058 177.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -62.35 -56.34 19.28 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 124.547 1.139 . . . . 10.0 108.373 174.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.42 -33.34 30.07 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.76 -47.25 75.86 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.242 -0.911 . . . . 10.0 111.829 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -57.01 -47.83 82.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.702 0.801 . . . . 10.0 111.119 170.048 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -64.38 -36.39 83.98 Favored 'General case' 0 C--O 1.228 -0.074 0 O-C-N 121.243 -0.911 . . . . 10.0 113.192 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -49.57 -49.69 45.36 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.728 0.695 . . . . 10.0 111.088 176.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 75.8 mtm -66.45 -45.16 80.74 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.996 0.518 . . . . 10.0 112.39 -179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.56 -71.79 0.09 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 118.774 -0.632 . . . . 10.0 112.566 172.477 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt 152.21 57.87 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 130.073 3.349 . . . . 10.0 112.106 -178.346 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -170.56 -75.52 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 114.505 1.298 . . . . 10.0 114.505 170.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.3 pttp . . . . . 0 C--O 1.254 1.303 0 C-N-CA 125.666 1.586 . . . . 10.0 114.626 -172.571 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.859 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.125 0 CA-C-O 117.408 -1.282 . . . . 10.0 109.187 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -162.82 127.51 3.11 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.679 0.792 . . . . 10.0 110.39 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.92 72.75 0.79 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.762 2.025 . . . . 10.0 108.767 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -102.96 -25.38 13.48 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.838 1.255 . . . . 10.0 112.31 172.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -149.43 112.93 5.0 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.64 0.776 . . . . 10.0 110.027 178.822 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -32.17 -46.65 0.13 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.816 2.046 . . . . 10.0 115.158 162.221 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.0 tt0 -58.66 -48.58 80.58 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 118.833 0.742 . . . . 10.0 110.724 173.214 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.46 -33.98 76.23 Favored 'General case' 0 C--O 1.226 -0.159 0 O-C-N 121.893 -0.504 . . . . 10.0 110.327 -177.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.7 mm -65.83 -51.0 66.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-O 118.459 -0.781 . . . . 10.0 109.212 176.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.482 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -67.8 -40.41 83.89 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 117.686 -1.605 . . . . 10.0 111.445 -179.656 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -68.88 -23.38 64.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.389 1.476 . . . . 10.0 112.957 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -27.85 15.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.985 1.314 . . . . 10.0 112.831 171.802 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.475 ' O ' HMC3 ' A' ' 90' ' ' HEC . . . -112.71 -65.81 1.15 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.76 1.224 . . . . 10.0 113.456 -172.634 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.482 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.94 45.58 0.35 Allowed 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 124.159 0.984 . . . . 10.0 110.148 179.731 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.0 t -129.22 -15.14 4.21 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 120.459 -1.401 . . . . 10.0 113.856 -162.502 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 19.6 m -97.59 -42.83 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 C-N-CA 124.185 0.994 . . . . 10.0 109.552 -177.227 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.7 m -85.8 -64.34 1.17 Allowed 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 126.831 2.052 . . . . 10.0 110.262 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -73.49 -26.1 60.74 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.637 0.977 . . . . 10.0 113.637 -165.159 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.0 t -56.06 -49.27 74.24 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.896 0.878 . . . . 10.0 111.136 -178.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.0 mmt -112.88 -9.21 13.66 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.726 0.81 . . . . 10.0 112.445 -178.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.61 42.88 8.12 Favored Glycine 0 CA--C 1.533 1.197 0 O-C-N 121.575 -0.703 . . . . 10.0 111.896 -179.1 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 50.1 t -88.89 161.27 2.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 125.081 1.352 . . . . 10.0 109.12 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.7 18.16 4.59 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.42 1.088 . . . . 10.0 113.933 -175.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 84.54 11.55 77.35 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.69 1.138 . . . . 10.0 113.787 -176.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.08 152.09 94.78 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-N 118.702 1.251 . . . . 10.0 113.757 -174.148 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -76.75 138.42 18.92 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.12 2.546 . . . . 10.0 110.83 -176.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.62 127.38 22.73 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.226 1.01 . . . . 10.0 113.008 -173.356 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 91.0 p 0.84 -82.39 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 128.15 2.58 . . . . 10.0 115.349 171.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.6 p80 -144.66 110.95 5.55 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 122.073 0.939 . . . . 10.0 110.051 170.636 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -128.45 -178.37 4.54 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.589 1.556 . . . . 10.0 110.235 174.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.9 t -99.35 -32.79 10.99 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.333 0.515 . . . . 10.0 112.11 169.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.42 -53.48 57.07 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.585 -1.322 . . . . 10.0 114.306 -171.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -79.74 -21.86 43.98 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.622 0.725 . . . . 10.0 110.837 -178.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.442 ' HE3' ' HB3' ' A' ' 77' ' ' ALA . 71.9 m95 -79.64 -29.28 40.95 Favored 'General case' 0 CA--C 1.554 1.114 0 O-C-N 121.348 -0.845 . . . . 10.0 112.259 174.511 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -47.12 -61.41 2.85 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.641 1.576 . . . . 10.0 114.955 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -62.91 -16.39 53.61 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.186 1.924 . . . . 10.0 112.914 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.6 mmt85 -82.92 -46.43 12.97 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.766 1.226 . . . . 10.0 108.34 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.606 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -63.11 -17.9 62.83 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.381 1.872 . . . . 10.0 112.518 172.888 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.18 -33.15 26.26 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.452 1.101 . . . . 10.0 109.666 177.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -74.84 -51.62 13.5 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 122.236 0.215 . . . . 10.0 111.075 171.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 156.21 -104.52 0.25 Allowed Glycine 0 CA--C 1.531 1.082 0 C-N-CA 123.088 0.375 . . . . 10.0 112.626 170.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.54 -61.62 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 123.98 0.912 . . . . 10.0 110.439 175.672 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.408 ' HA ' HG12 ' A' ' 43' ' ' VAL . 0.9 OUTLIER -76.71 36.44 0.16 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.333 1.453 . . . . 10.0 113.096 -170.94 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -111.99 -54.1 2.64 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.786 -1.931 . . . . 10.0 105.786 -176.632 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -79.56 -33.71 41.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.201 1.0 . . . . 10.0 111.618 -177.592 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.408 HG12 ' HA ' ' A' ' 40' ' ' ASP . 0.5 OUTLIER -64.02 -11.21 9.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.65 -0.656 . . . . 10.0 111.8 170.756 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.6 mmpt? -78.78 -45.3 21.3 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.017 -1.052 . . . . 10.0 111.383 163.186 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 33.9 m -63.9 -38.27 90.45 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 120.294 -1.504 . . . . 10.0 110.766 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -56.57 -39.45 62.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 121.424 0.631 . . . . 10.0 111.968 177.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HA ' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -77.39 -29.66 53.25 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.003 0.521 . . . . 10.0 111.776 -179.811 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 99.2 m -73.11 -32.12 64.74 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.447 0.699 . . . . 10.0 112.623 175.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.12 111.54 0.92 Allowed Glycine 0 C--N 1.34 0.778 0 N-CA-C 110.327 -1.109 . . . . 10.0 110.327 -170.086 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.44 -163.18 0.09 Allowed 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.685 1.194 . . . . 10.0 109.278 162.571 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -74.12 -67.42 0.61 Allowed 'General case' 0 N--CA 1.476 0.826 0 O-C-N 119.888 -1.758 . . . . 10.0 112.492 -170.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.38 -33.9 77.04 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.217 1.007 . . . . 10.0 111.166 173.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -73.03 128.96 87.07 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 126.4 1.88 . . . . 10.0 112.086 -172.166 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.16 144.23 68.18 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 121.632 1.555 . . . . 10.0 110.135 177.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -61.27 126.38 19.23 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.551 2.167 . . . . 10.0 109.439 175.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.436 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 93.06 25.53 19.31 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 120.987 -0.625 . . . . 10.0 112.939 179.465 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.83 35.11 4.23 Favored Glycine 0 CA--C 1.543 1.837 0 CA-C-N 118.002 0.901 . . . . 10.0 114.507 -177.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 14.3 ttm 70.13 -4.04 1.64 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.247 2.219 . . . . 10.0 114.926 -176.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.51 -38.88 6.61 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.064 -1.023 . . . . 10.0 112.511 -179.096 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 72.9 m 67.38 -60.65 0.37 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.517 1.927 . . . . 10.0 112.86 -176.36 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -79.64 57.05 2.37 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.724 1.21 . . . . 10.0 110.351 -177.296 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -112.15 123.0 49.31 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.154 1.382 . . . . 10.0 110.655 -171.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.4 t -93.57 133.31 37.01 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 173.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -32.37 -41.73 0.06 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.893 2.077 . . . . 10.0 113.326 171.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -40.61 -61.29 0.96 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.692 1.197 . . . . 10.0 113.7 170.19 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.12 -28.3 24.09 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.674 0.67 . . . . 10.0 111.383 178.102 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -43.7 78.31 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.948 -1.095 . . . . 10.0 111.244 176.771 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.7 ptmm? -72.49 -45.16 60.77 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.513 1.125 . . . . 10.0 109.698 178.076 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.504 ' HA ' ' HG2' ' A' ' 72' ' ' GLU . . . -50.25 -38.03 38.72 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 121.798 0.809 . . . . 10.0 111.889 173.476 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.29 -41.78 76.34 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.912 0.885 . . . . 10.0 111.851 -176.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 27.3 pt -76.24 -42.28 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 O-C-N 121.751 -0.593 . . . . 10.0 111.761 175.16 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . 0.504 ' HG2' ' HA ' ' A' ' 69' ' ' ALA 0.258 5.7 pt-20 -64.67 -25.09 67.8 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.659 -0.651 . . . . 10.0 111.905 177.827 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -49.33 -44.43 44.48 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.587 0.63 . . . . 10.0 112.112 164.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 70.0 mtm -82.0 -57.26 3.49 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.464 0.705 . . . . 10.0 110.332 178.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.1 t -177.65 121.21 0.11 Allowed 'General case' 0 C--O 1.223 -0.31 0 C-N-CA 126.822 2.049 . . . . 10.0 108.207 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.57 83.1 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.001 -1.062 . . . . 10.0 112.984 178.26 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.606 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -157.76 -69.58 0.09 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 114.055 1.131 . . . . 10.0 114.055 -178.167 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.701 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 4.7 ptpp? . . . . . 0 C--O 1.249 1.072 0 C-N-CA 124.198 0.999 . . . . 10.0 112.103 -177.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.701 HMA3 ' HB2' ' A' ' 78' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 117.205 -1.378 . . . . 10.0 109.409 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -162.56 134.38 5.31 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.387 0.994 . . . . 10.0 111.012 -170.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -1' ' ' LEU . . . . . 0.446 HD22 ' O ' ' A' ' -1' ' ' LEU . 0.0 OUTLIER -73.83 51.72 0.39 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.848 1.259 . . . . 10.0 112.701 -174.449 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.39 -18.55 18.23 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.15 0.98 . . . . 10.0 113.134 -166.242 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -138.18 -172.46 3.28 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.35 2.26 . . . . 10.0 106.399 179.213 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.434 ' HB1' ' HA ' ' A' ' 70' ' ' ALA . . . -89.56 -45.65 9.23 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.653 2.381 . . . . 10.0 111.562 174.551 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -55.02 -50.09 69.9 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-O 121.931 0.872 . . . . 10.0 110.43 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.82 -31.44 69.33 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.464 -177.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -66.72 -52.06 49.45 Favored 'Isoleucine or valine' 0 C--N 1.34 0.18 0 N-CA-C 108.273 -1.01 . . . . 10.0 108.273 176.081 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -41.49 75.99 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 119.461 1.028 . . . . 10.0 110.328 -174.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -69.14 -23.97 64.03 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.464 1.106 . . . . 10.0 112.254 -178.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.7 ttpp -86.16 -30.48 22.45 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.18 -0.95 . . . . 10.0 113.423 166.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.38 -69.5 0.86 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.226 1.011 . . . . 10.0 112.84 -164.419 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.39 31.9 0.09 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.876 1.67 . . . . 10.0 111.234 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.9 t -111.38 8.71 21.38 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 124.624 1.17 . . . . 10.0 113.268 -164.183 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.7 t -111.42 -45.88 5.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.772 1.229 . . . . 10.0 108.902 -173.035 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.7 m -92.44 -64.24 1.13 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.946 1.699 . . . . 10.0 111.423 176.691 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -73.08 -25.65 60.97 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.425 0.69 . . . . 10.0 112.426 -166.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.03 -53.43 55.93 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.648 1.179 . . . . 10.0 111.014 -179.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.6 ttt -105.43 -21.03 13.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.283 1.033 . . . . 10.0 112.047 -178.118 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.95 53.48 2.37 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.111 0.862 . . . . 10.0 112.095 -175.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.8 t -95.05 162.66 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 125.131 1.372 . . . . 10.0 109.299 177.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 60.01 16.37 5.8 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.657 1.183 . . . . 10.0 113.976 -177.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.5 22.12 79.13 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 123.524 0.583 . . . . 10.0 113.028 -171.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.95 157.07 77.84 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 124.104 0.962 . . . . 10.0 112.07 177.242 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -72.79 165.27 33.23 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 122.577 2.185 . . . . 10.0 110.606 -178.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.9 tptt -77.37 126.42 30.88 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.652 -175.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.7 t -34.02 -42.69 0.13 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.391 2.276 . . . . 10.0 114.573 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.0 p-80 -138.59 133.51 32.6 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 108.459 -0.941 . . . . 10.0 108.459 157.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -148.59 168.43 22.79 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 125.565 1.546 . . . . 10.0 108.75 170.13 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.3 t -104.75 -36.83 7.29 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 120.567 -0.453 . . . . 10.0 111.438 164.459 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.57 -23.47 42.73 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 119.959 -1.713 . . . . 10.0 114.025 -174.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -82.68 -34.58 27.32 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.092 1.357 . . . . 10.0 109.33 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.45 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 45.9 m95 -85.82 -34.44 21.08 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 125.899 1.68 . . . . 10.0 111.907 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -43.63 -57.27 5.91 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 125.227 1.411 . . . . 10.0 114.43 174.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -65.25 -5.67 11.63 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.648 2.232 . . . . 10.0 113.898 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.442 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 8.8 mmt180 -103.05 -46.99 4.48 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.863 1.265 . . . . 10.0 110.369 179.038 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.2 mt -55.06 -4.3 0.07 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.883 1.673 . . . . 10.0 114.405 166.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.67 -33.31 17.62 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.087 1.355 . . . . 10.0 110.193 -176.691 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.53 -54.36 6.23 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 171.341 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 166.58 -132.89 2.75 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 110.916 -0.874 . . . . 10.0 110.916 -177.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 62.5 t -140.39 -56.92 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 124.181 0.992 . . . . 10.0 110.476 -173.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.42 ' HA ' HG12 ' A' ' 43' ' ' VAL . 62.2 m-20 -69.88 11.19 0.31 Allowed 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 113.701 1.0 . . . . 10.0 113.701 -176.695 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -92.68 -21.67 19.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 127.516 2.327 . . . . 10.0 111.143 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.667 ' HB3' HMA2 ' A' ' 90' ' ' HEC . 0.6 OUTLIER -106.4 -32.16 8.25 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.522 0.729 . . . . 10.0 110.874 -177.912 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' A' ' 40' ' ' ASP . 1.8 p -60.31 -23.79 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 125.68 1.592 . . . . 10.0 111.281 169.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.53 -44.66 57.08 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 121.363 -0.835 . . . . 10.0 111.875 167.189 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.598 ' HA ' HG22 ' A' ' 48' ' ' THR . 0.4 OUTLIER -76.05 -23.87 55.12 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 120.989 -1.069 . . . . 10.0 111.901 -174.319 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.426 HG13 ' CZ ' ' A' ' 67' ' ' TYR . 1.7 p -68.95 -40.64 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 O-C-N 121.027 -1.045 . . . . 10.0 111.129 172.773 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.64 -31.0 66.38 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.149 0.5 . . . . 10.0 111.372 -178.651 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' THR . . . . . 0.598 HG22 ' HA ' ' A' ' 45' ' ' SER . 1.5 t -89.43 -22.39 22.54 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.0 1.32 . . . . 10.0 112.495 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.05 117.56 0.82 Allowed Glycine 0 CA--C 1.535 1.307 0 N-CA-C 111.355 -0.698 . . . . 10.0 111.355 -170.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 tp -74.42 -152.48 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.992 0 O-C-N 122.031 -0.687 . . . . 10.0 110.393 169.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -65.27 -63.9 0.99 Allowed 'General case' 0 N--CA 1.471 0.618 0 O-C-N 119.753 -1.842 . . . . 10.0 111.592 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -101.39 44.19 1.02 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 113.282 -1.781 . . . . 10.0 109.084 -175.187 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -143.12 134.76 12.91 Favored Pre-proline 0 CA--C 1.536 0.42 0 C-N-CA 124.58 1.152 . . . . 10.0 111.606 -177.623 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.42 156.41 45.65 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 121.866 1.711 . . . . 10.0 110.211 176.106 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.67 120.52 7.64 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 122.759 2.306 . . . . 10.0 110.165 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.6 34.97 6.35 Favored Glycine 0 CA--C 1.531 1.087 0 O-C-N 122.091 -0.381 . . . . 10.0 113.242 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.415 ' HA3' HBB2 ' A' ' 90' ' ' HEC . . . 57.18 -84.27 0.01 OUTLIER Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.556 1.074 . . . . 10.0 114.345 172.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -175.0 38.93 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.986 2.114 . . . . 10.0 112.376 165.322 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.45 147.77 49.08 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.751 1.221 . . . . 10.0 111.153 -175.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.8 t -71.42 -50.13 34.93 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -173.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -123.81 76.13 1.41 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.229 1.412 . . . . 10.0 108.473 175.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 8.3 m -71.87 91.1 1.15 Allowed 'General case' 0 CA--C 1.538 0.5 0 O-C-N 120.889 -1.132 . . . . 10.0 111.19 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -78.51 149.39 33.14 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 121.151 -0.968 . . . . 10.0 108.495 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.79 -37.32 76.07 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 120.315 1.416 . . . . 10.0 112.084 172.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.2 pt-20 -51.49 -46.6 63.22 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 119.065 -0.493 . . . . 10.0 111.608 174.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 -82.85 -39.43 21.64 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.829 0.74 . . . . 10.0 112.624 176.584 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CZ ' HG13 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -55.99 -46.22 78.78 Favored 'General case' 0 N--CA 1.463 0.22 0 O-C-N 120.5 -1.375 . . . . 10.0 111.543 -178.226 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -68.5 -45.79 71.39 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 -177.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.66 -38.97 61.37 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 121.633 0.73 . . . . 10.0 112.647 169.1 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.434 ' HA ' ' HB1' ' A' ' 3' ' ' ALA . . . -80.05 -39.55 29.56 Favored 'General case' 0 C--O 1.225 -0.226 0 O-C-N 120.602 -1.311 . . . . 10.0 113.592 -174.804 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.0 mt -70.38 -38.18 73.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 O-C-N 121.831 -0.543 . . . . 10.0 110.466 171.153 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . 0.299 0.0 OUTLIER -69.59 -31.71 70.02 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 114.195 1.183 . . . . 10.0 114.195 176.629 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -42.02 -47.14 4.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.628 1.171 . . . . 10.0 112.17 173.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.45 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.2 mpp? -81.65 -73.14 0.4 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.505 0.558 . . . . 10.0 112.505 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.2 33.87 0.17 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.155 0.582 . . . . 10.0 112.063 178.59 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.269 16.0 ptpt 42.62 46.81 4.4 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.892 1.677 . . . . 10.0 114.137 -179.297 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.496 ' O ' HMA3 ' A' ' 90' ' ' HEC . . . -150.97 -92.71 0.06 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.965 1.469 . . . . 10.0 114.965 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.4 ' HB2' ' CAA' ' A' ' 90' ' ' HEC . 7.4 pttt . . . . . 0 C--O 1.253 1.25 0 N-CA-C 116.071 1.878 . . . . 10.0 116.071 -175.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.713 HMC1 ' CBC' ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.335 0 N-CA-C 112.75 0.648 . . . . 10.0 112.75 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -167.4 128.39 1.51 Allowed 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 123.212 0.605 . . . . 10.0 109.943 -171.38 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' -1' ' ' LEU . . . . . 0.402 ' HA ' HD11 ' A' ' 6' ' ' ILE . 2.6 tp -76.78 67.96 2.93 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.434 0.561 . . . . 10.0 110.831 177.659 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -111.52 -19.69 12.46 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.817 1.043 . . . . 10.0 113.817 179.369 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -139.69 -137.44 0.12 Allowed 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.365 1.066 . . . . 10.0 110.366 -172.162 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -147.94 -49.45 0.17 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 130.344 3.457 . . . . 10.0 109.302 -174.61 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -54.26 -50.51 67.07 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 121.247 0.546 . . . . 10.0 110.301 171.103 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 -29.75 68.69 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 121.777 -0.577 . . . . 10.0 111.415 -176.363 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.402 HD11 ' HA ' ' A' ' -1' ' ' LEU . 1.5 mp -68.8 -52.67 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.932 -1.136 . . . . 10.0 107.932 178.004 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.425 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -68.23 -41.25 81.53 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 118.225 -1.39 . . . . 10.0 110.918 -179.612 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -68.51 -22.95 64.5 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.132 1.373 . . . . 10.0 112.546 -176.779 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.72 -29.74 16.66 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.37 1.248 . . . . 10.0 114.37 166.298 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.27 -66.19 1.09 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.104 0.865 . . . . 10.0 112.363 -167.121 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.425 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.2 42.84 0.27 Allowed 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 124.126 0.971 . . . . 10.0 109.883 177.604 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.7 t -122.56 -6.88 8.64 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 120.477 -1.389 . . . . 10.0 114.03 -164.056 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.8 m -105.88 -41.97 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 123.59 0.756 . . . . 10.0 109.352 -178.219 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 m -86.88 -63.91 1.23 Allowed 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.657 1.583 . . . . 10.0 110.136 177.992 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -74.1 -28.23 61.26 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.277 1.214 . . . . 10.0 114.277 -167.954 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.1 t -59.58 -51.36 70.15 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.565 0.746 . . . . 10.0 111.408 -179.049 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 28.9 mmt -101.76 -19.49 15.33 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.434 0.694 . . . . 10.0 111.844 -179.531 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.18 49.59 4.17 Favored Glycine 0 CA--C 1.532 1.143 0 O-C-N 121.428 -0.795 . . . . 10.0 111.986 -178.222 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 66.6 t -99.29 162.95 2.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 126.127 1.771 . . . . 10.0 109.313 -177.816 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.68 19.66 8.34 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.411 1.084 . . . . 10.0 113.367 -176.237 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 81.23 10.29 84.94 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 124.522 1.058 . . . . 10.0 113.142 -174.941 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.96 144.49 95.77 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-N 118.422 1.111 . . . . 10.0 112.767 -176.863 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.446 ' CG ' ' HE3' ' A' ' 78' ' ' LYS . 42.6 Cg_endo -81.14 151.77 18.25 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 124.784 3.656 . . . . 10.0 110.392 179.349 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.2 mptt -103.25 143.2 32.96 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.211 -166.308 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.3 p -77.05 55.23 1.11 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.207 1.003 . . . . 10.0 112.46 175.131 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -146.96 -45.59 0.18 Allowed 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 114.072 1.138 . . . . 10.0 114.072 175.939 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -71.25 149.2 46.45 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 108.369 -0.974 . . . . 10.0 108.369 -177.925 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 9.5 t -95.46 -30.5 13.83 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 118.652 0.66 . . . . 10.0 110.139 178.111 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.42 -29.08 69.72 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 114.65 1.352 . . . . 10.0 114.65 -178.234 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -76.42 -31.39 57.88 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 122.34 1.067 . . . . 10.0 111.075 176.832 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 73.4 m95 -89.47 -32.02 17.41 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.32 1.448 . . . . 10.0 112.355 -177.038 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -49.18 -57.45 11.57 Favored Pre-proline 0 CA--C 1.542 0.667 0 O-C-N 120.461 -1.4 . . . . 10.0 114.609 175.509 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -65.72 -1.33 4.8 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 122.609 2.206 . . . . 10.0 113.209 178.617 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.5 mmt85 -101.14 -55.16 2.62 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.987 1.315 . . . . 10.0 108.513 176.806 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.519 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 1.0 OUTLIER -60.07 -13.73 13.15 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.725 1.61 . . . . 10.0 114.472 175.827 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -86.11 -38.84 17.34 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 124.363 1.065 . . . . 10.0 109.422 -174.135 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.49 -45.56 37.63 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.549 -0.75 . . . . 10.0 110.932 174.594 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 161.92 -136.32 4.32 Favored Glycine 0 CA--C 1.533 1.158 0 N-CA-C 110.822 -0.911 . . . . 10.0 110.822 -178.942 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 67.0 t -139.61 -57.53 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 122.524 1.154 . . . . 10.0 111.048 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -43.33 -36.78 1.99 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.281 1.832 . . . . 10.0 112.988 170.949 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -47.21 -27.32 1.45 Allowed 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.822 1.045 . . . . 10.0 113.822 173.883 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.468 ' HB3' ' CMA' ' A' ' 90' ' ' HEC . 1.1 mm? -100.45 -38.48 8.39 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 125.206 1.402 . . . . 10.0 111.471 179.535 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -53.26 -36.81 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 CA-C-N 118.912 0.778 . . . . 10.0 110.285 170.887 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.9 ptmt -63.72 -44.24 94.17 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.145 1.165 . . . . 10.0 114.145 171.446 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.7 m -64.46 -33.96 77.1 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 120.91 -1.119 . . . . 10.0 110.241 178.669 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.6 t -62.42 -55.0 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 123.736 0.814 . . . . 10.0 112.072 176.328 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.82 -36.97 65.56 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.762 0.315 . . . . 10.0 111.617 177.28 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 21.7 m -71.13 -34.67 71.26 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.945 0.898 . . . . 10.0 111.79 -177.802 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 75.4 112.32 0.1 Allowed Glycine 0 C--N 1.339 0.701 0 N-CA-C 110.596 -1.002 . . . . 10.0 110.596 -167.951 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.0 tp -68.9 -170.48 0.23 Allowed 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 121.501 0.667 . . . . 10.0 109.708 167.232 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -68.09 -61.01 2.05 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 119.559 -1.963 . . . . 10.0 112.023 -167.323 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.97 -40.85 83.07 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.789 1.236 . . . . 10.0 112.041 172.154 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.8 ttt -74.45 120.85 83.47 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 126.572 1.949 . . . . 10.0 112.594 -174.005 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -63.5 156.9 53.92 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.264 1.976 . . . . 10.0 111.712 -177.558 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -57.87 141.85 96.09 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 123.296 2.664 . . . . 10.0 110.475 178.143 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.23 22.01 72.42 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 120.177 -1.011 . . . . 10.0 113.451 -175.992 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.96 29.48 4.53 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 124.435 1.017 . . . . 10.0 114.462 -176.422 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.9 ttt 75.01 23.87 1.59 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.115 1.766 . . . . 10.0 114.382 -178.057 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.5 t -95.26 155.9 16.54 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 121.107 -0.995 . . . . 10.0 113.228 -179.086 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 41.4 m -69.75 -82.22 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.125 0.97 . . . . 10.0 112.552 178.627 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -125.49 43.12 3.13 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.421 1.088 . . . . 10.0 110.61 -176.711 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.27 126.96 29.74 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.224 -0.922 . . . . 10.0 111.658 -179.174 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.5 m -97.66 -83.49 0.4 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.544 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -156.08 -53.75 0.08 Allowed 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 127.278 2.231 . . . . 10.0 110.162 179.9 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -51.93 -42.53 62.87 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.08 0.552 . . . . 10.0 111.413 178.018 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -47.43 45.84 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 106.977 -1.49 . . . . 10.0 106.977 -178.045 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.24 -52.7 63.68 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.789 1.636 . . . . 10.0 111.798 -173.545 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -66.92 -42.31 85.58 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 125.055 1.342 . . . . 10.0 109.083 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.6 -35.46 63.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.448 1.022 . . . . 10.0 112.772 170.746 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.9 -47.01 49.49 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 120.293 -1.504 . . . . 10.0 111.099 177.841 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.1 mt -63.61 -37.61 80.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.982 1.313 . . . . 10.0 112.309 177.148 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -71.42 -30.33 65.94 Favored 'General case' 0 C--O 1.231 0.088 0 C-N-CA 124.606 1.162 . . . . 10.0 111.152 176.411 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -53.44 -30.09 38.76 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 112.927 0.714 . . . . 10.0 112.927 171.288 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 71.0 mtm -90.09 -72.72 0.55 Allowed 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.628 -0.67 . . . . 10.0 112.629 178.692 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.49 37.73 0.24 Allowed 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.765 -0.584 . . . . 10.0 112.497 176.24 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.7 ptmt 40.66 56.5 2.79 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 126.057 1.743 . . . . 10.0 114.665 172.489 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.519 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -159.72 -78.35 0.06 Allowed 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 124.371 1.068 . . . . 10.0 111.357 170.211 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.446 ' HE3' ' CG ' ' A' ' 23' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.242 0.666 0 N-CA-C 113.003 0.742 . . . . 10.0 113.003 -176.602 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.532 HMB1 HBB3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 118.627 -0.701 . . . . 10.0 110.448 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -163.51 41.97 0.1 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 122.247 1.022 . . . . 10.0 111.014 -171.723 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.27 74.32 1.09 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 127.749 2.419 . . . . 10.0 108.737 179.211 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -114.82 -21.1 10.32 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 114.848 1.425 . . . . 10.0 114.848 172.781 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -156.52 120.49 4.37 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.613 0.721 . . . . 10.0 109.605 179.85 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -43.97 -39.14 3.87 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 114.741 1.386 . . . . 10.0 114.741 170.158 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -56.62 -47.95 78.53 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 121.874 -0.516 . . . . 10.0 110.51 172.365 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.23 -33.09 73.76 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.837 -0.539 . . . . 10.0 110.87 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 12.8 mm -65.17 -52.07 57.62 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 176.147 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.57 -41.78 79.23 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 118.144 -1.422 . . . . 10.0 111.438 -178.244 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -68.79 -22.64 64.26 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.08 1.352 . . . . 10.0 112.473 -176.756 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -94.42 -28.41 15.52 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.081 1.141 . . . . 10.0 114.081 168.676 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.23 -63.84 1.25 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.14 0.976 . . . . 10.0 113.005 -171.749 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.4 35.6 0.15 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.198 1.399 . . . . 10.0 111.04 -178.303 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.4 t -124.94 -1.57 7.81 Favored 'General case' 0 N--CA 1.46 0.054 0 C-N-CA 124.97 1.308 . . . . 10.0 113.779 -163.74 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.2 t -104.56 -47.83 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 124.783 1.233 . . . . 10.0 108.957 -173.016 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.5 m -84.33 -65.53 1.0 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.186 1.395 . . . . 10.0 110.717 172.05 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -74.4 -20.81 59.92 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.169 1.544 . . . . 10.0 115.169 -163.004 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m -64.73 -44.64 89.5 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 118.392 0.542 . . . . 10.0 110.979 176.845 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.8 mmt -102.17 -22.88 14.11 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.819 1.247 . . . . 10.0 111.899 -177.057 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.13 41.7 6.96 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.094 0.854 . . . . 10.0 111.931 -175.169 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 84.7 t -87.6 159.81 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 124.459 1.104 . . . . 10.0 109.417 179.076 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.63 16.17 5.21 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.938 1.295 . . . . 10.0 113.571 -174.342 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.92 16.18 80.24 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.212 0.91 . . . . 10.0 113.361 -172.803 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.78 132.79 94.0 Favored Pre-proline 0 CA--C 1.544 0.721 0 CA-C-N 118.649 1.224 . . . . 10.0 113.339 -174.55 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.11 140.85 61.25 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.788 2.992 . . . . 10.0 111.206 -178.589 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.36 145.21 55.97 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.809 0.814 . . . . 10.0 112.353 -166.712 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.9 p -51.34 -37.64 48.91 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.39 1.076 . . . . 10.0 113.275 176.455 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -122.19 40.88 3.54 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.398 1.258 . . . . 10.0 114.398 -174.598 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -85.03 165.35 17.61 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.425 -0.797 . . . . 10.0 112.099 174.103 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.2 t -104.34 -34.94 8.13 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.427 0.291 . . . . 10.0 111.415 165.663 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.43 -33.64 60.94 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 120.787 -1.195 . . . . 10.0 113.035 -174.689 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -73.15 -28.9 62.5 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.105 0.479 . . . . 10.0 110.366 179.305 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 69.7 m95 -91.67 -35.46 14.18 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.764 2.026 . . . . 10.0 110.938 -174.949 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -40.28 -63.17 0.76 Allowed Pre-proline 0 CA--C 1.547 0.832 0 N-CA-C 115.038 1.496 . . . . 10.0 115.038 174.173 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -66.19 -6.12 13.98 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.867 2.378 . . . . 10.0 113.497 -178.664 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.519 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 5.5 mmt85 -98.98 -45.63 5.89 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.977 1.711 . . . . 10.0 108.994 -177.916 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -24.39 63.51 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.818 2.047 . . . . 10.0 110.702 177.556 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.47 -28.53 52.36 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.366 1.066 . . . . 10.0 109.747 176.378 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt -77.38 -52.5 9.04 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.5 0.32 . . . . 10.0 110.519 172.654 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 164.63 -106.8 0.28 Allowed Glycine 0 CA--C 1.531 1.061 0 C-N-CA 123.558 0.599 . . . . 10.0 111.75 172.823 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -153.83 -61.58 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 C-N-CA 123.971 0.908 . . . . 10.0 109.413 177.405 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.482 ' HA ' HG12 ' A' ' 43' ' ' VAL . 1.3 m-20 -72.6 24.52 0.06 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.035 1.334 . . . . 10.0 113.242 -171.53 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.409 ' HB2' HD22 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -106.57 -25.64 11.73 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 127.705 2.402 . . . . 10.0 108.822 -176.767 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.409 HD22 ' HB2' ' A' ' 41' ' ' ASN . 3.5 mm? -99.52 -42.48 6.91 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.892 1.277 . . . . 10.0 110.85 178.948 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.482 HG12 ' HA ' ' A' ' 40' ' ' ASP . 2.7 p -53.25 -35.74 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 122.884 0.474 . . . . 10.0 111.069 171.985 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 ptmt -59.93 -43.6 94.85 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.717 -1.239 . . . . 10.0 112.419 171.767 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.7 m -72.46 -33.78 67.27 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.692 -0.63 . . . . 10.0 110.72 -176.765 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -47.57 85.62 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 O-C-N 122.067 -0.396 . . . . 10.0 111.197 172.617 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -30.8 71.11 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.788 0.328 . . . . 10.0 111.725 177.005 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.89 -35.95 64.72 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.535 0.939 . . . . 10.0 113.535 179.386 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.47 109.25 0.53 Allowed Glycine 0 CA--C 1.529 0.947 0 N-CA-C 111.254 -0.738 . . . . 10.0 111.254 -167.175 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.71 -154.79 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.139 0.975 . . . . 10.0 109.147 168.959 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -73.04 -66.53 0.66 Allowed 'General case' 0 N--CA 1.479 0.978 0 O-C-N 119.231 -2.168 . . . . 10.0 111.557 -174.875 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.35 -21.48 61.3 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.329 1.052 . . . . 10.0 111.801 174.396 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.4 mtm -84.87 125.2 71.44 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 112.525 0.565 . . . . 10.0 112.525 -179.668 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.51 150.09 69.27 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.063 1.842 . . . . 10.0 111.194 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -60.8 115.07 2.44 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 123.342 2.695 . . . . 10.0 109.817 179.669 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 95.5 10.78 56.56 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 121.309 -0.472 . . . . 10.0 113.559 -175.479 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.98 53.49 7.42 Favored Glycine 0 CA--C 1.536 1.391 0 CA-C-N 118.508 1.154 . . . . 10.0 113.233 175.156 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 83.02 -41.02 0.1 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 127.012 2.125 . . . . 10.0 112.588 -176.797 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.0 t -78.88 176.46 9.57 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.677 -0.64 . . . . 10.0 110.857 174.437 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.0 p -125.17 -73.59 0.63 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.912 1.285 . . . . 10.0 108.282 167.644 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -79.02 58.99 2.56 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.632 1.973 . . . . 10.0 110.439 -179.112 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 25.6 m -109.4 143.82 38.44 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.196 0.998 . . . . 10.0 112.729 169.949 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 98.8 m -125.83 151.09 47.28 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 125.389 1.476 . . . . 10.0 109.922 -178.781 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -39.59 -38.41 0.6 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.7 2.0 . . . . 10.0 114.82 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -35.33 -53.24 0.64 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.867 1.267 . . . . 10.0 114.349 168.362 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -99.63 -26.51 14.06 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.515 1.526 . . . . 10.0 113.274 171.841 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -50.38 40.9 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.391 -1.443 . . . . 10.0 110.665 -176.187 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.9 tttt -67.58 -50.71 57.04 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 123.794 0.838 . . . . 10.0 108.909 179.606 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.11 -26.08 2.51 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.512 0.93 . . . . 10.0 113.512 173.413 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.69 -39.38 20.24 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.893 1.277 . . . . 10.0 110.676 -179.839 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' ILE . . . . . 0.419 HD11 HMB2 ' A' ' 90' ' ' HEC . 3.5 mt -72.85 -45.99 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 125.456 1.502 . . . . 10.0 111.789 177.651 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.84 -26.61 67.74 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.434 1.094 . . . . 10.0 112.73 177.229 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -53.43 -28.54 30.57 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.399 0.889 . . . . 10.0 113.399 169.649 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 62.7 mtm -87.59 -78.05 0.32 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.69 0.796 . . . . 10.0 112.104 179.676 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.4 t -153.37 37.61 0.48 Allowed 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.823 -0.548 . . . . 10.0 111.588 176.255 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt 32.78 66.14 0.21 Allowed 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.532 1.933 . . . . 10.0 114.915 174.669 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.519 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -160.09 -53.86 0.06 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.419 0.896 . . . . 10.0 113.419 -176.959 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.478 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.604 0 C-N-CA 126.15 1.78 . . . . 10.0 111.344 -179.704 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.712 HMC1 ' CBC' ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 117.96 -1.019 . . . . 10.0 110.048 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -163.34 55.68 0.18 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 122.191 0.995 . . . . 10.0 110.702 -168.862 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -129.68 39.8 3.67 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 124.601 1.161 . . . . 10.0 112.734 -178.827 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -99.07 -23.94 15.08 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.625 0.972 . . . . 10.0 113.625 -175.405 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -142.98 128.78 19.37 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.112 -1.07 . . . . 10.0 108.112 171.754 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -52.87 -38.31 61.45 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.44 1.096 . . . . 10.0 112.983 172.128 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -56.61 -48.7 76.9 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.781 0.324 . . . . 10.0 110.275 170.206 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.91 -32.22 70.42 Favored 'General case' 0 CA--C 1.528 0.103 0 O-C-N 121.696 -0.627 . . . . 10.0 111.72 -177.611 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.434 ' CD1' ' HB3' ' A' ' 66' ' ' ASP . 36.0 mt -64.76 -52.96 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 N-CA-C 107.328 -1.36 . . . . 10.0 107.328 176.252 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.473 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -69.38 -42.52 75.06 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 117.934 -1.506 . . . . 10.0 111.457 -176.298 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -70.49 -24.03 62.78 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.689 1.595 . . . . 10.0 113.148 -176.618 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.14 -31.29 19.24 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.12 0.873 . . . . 10.0 111.984 167.604 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.594 ' O ' HMC3 ' A' ' 90' ' ' HEC . . . -102.4 -68.23 0.84 Allowed 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 114.094 1.146 . . . . 10.0 114.094 -171.773 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.473 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.82 41.12 0.34 Allowed 'General case' 0 CA--C 1.554 1.107 0 CA-C-O 123.176 1.465 . . . . 10.0 109.238 -174.922 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.0 t -123.99 -10.23 7.67 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 126.34 1.856 . . . . 10.0 112.701 -164.644 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 49.2 t -92.97 -51.62 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 C-N-CA 125.401 1.48 . . . . 10.0 108.102 -177.215 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.7 m -95.14 -57.12 2.51 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.701 1.601 . . . . 10.0 109.816 -171.771 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -73.15 -23.98 60.53 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.001 0.92 . . . . 10.0 112.914 -169.789 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.7 t -62.46 -40.43 96.61 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.799 0.809 . . . . 10.0 111.332 -173.802 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.3 tpt -118.77 -32.49 4.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.564 1.545 . . . . 10.0 112.337 -178.198 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.82 58.9 1.55 Allowed Glycine 0 CA--C 1.534 1.252 0 C-N-CA 124.704 1.145 . . . . 10.0 113.343 -176.687 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 96.0 t -82.35 -57.44 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 O-C-N 121.637 -0.92 . . . . 10.0 112.625 -176.581 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.05 31.22 0.38 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.035 0.934 . . . . 10.0 111.113 179.78 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 62.28 25.78 67.03 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 123.763 0.696 . . . . 10.0 112.552 -169.781 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.78 148.22 96.47 Favored Pre-proline 0 CA--C 1.54 0.578 0 O-C-N 122.015 -0.697 . . . . 10.0 111.467 177.079 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -77.62 142.4 20.51 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 123.287 2.658 . . . . 10.0 111.709 -171.15 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.39 130.18 30.58 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.347 1.24 . . . . 10.0 114.347 -172.295 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.0 m -17.33 -74.04 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 128.922 2.889 . . . . 10.0 115.627 -177.843 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -146.16 115.18 6.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 169.499 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -143.79 -175.74 4.7 Favored 'General case' 0 N--CA 1.443 -0.79 0 C-N-CA 124.325 1.05 . . . . 10.0 110.182 176.532 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 t -102.96 -30.0 11.06 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 170.014 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.47 -52.56 64.69 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 119.892 -1.755 . . . . 10.0 114.452 -173.98 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.429 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 9.5 t0 -77.8 -22.07 50.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.319 1.848 . . . . 10.0 110.049 -179.777 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.4 ' CE3' ' HB2' ' A' ' 75' ' ' SER . 54.3 m95 -86.74 -25.44 24.7 Favored 'General case' 0 CA--C 1.553 1.088 0 O-C-N 121.134 -0.979 . . . . 10.0 112.485 177.83 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -49.47 -56.91 13.75 Favored Pre-proline 0 CA--C 1.54 0.586 0 O-C-N 120.543 -1.348 . . . . 10.0 113.096 174.874 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -69.7 9.75 0.55 Allowed 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 122.457 2.104 . . . . 10.0 113.612 178.322 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -110.31 -49.97 3.01 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.477 1.511 . . . . 10.0 108.687 173.784 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 16.8 mt -63.43 9.01 0.06 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.51 1.924 . . . . 10.0 114.65 171.043 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -95.93 -29.16 14.32 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.406 1.482 . . . . 10.0 110.6 175.813 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.9 mmtt -92.47 -54.13 3.92 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.143 0.977 . . . . 10.0 109.968 179.844 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 166.72 -139.69 5.89 Favored Glycine 0 CA--C 1.533 1.167 0 N-CA-C 110.725 -0.95 . . . . 10.0 110.725 -178.543 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 60.5 t -132.75 -63.15 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.418 1.087 . . . . 10.0 109.545 -175.504 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.66 10.15 0.11 Allowed 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 125.98 1.712 . . . . 10.0 114.025 -176.447 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -90.63 -19.55 23.54 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 128.455 2.702 . . . . 10.0 111.48 176.743 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mt -106.48 -41.19 5.35 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.627 1.171 . . . . 10.0 109.028 -171.381 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.5 p -51.53 -37.0 18.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 C-N-CA 123.049 0.54 . . . . 10.0 111.556 168.227 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.3 ptmt -62.79 -39.22 93.56 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.022 -1.049 . . . . 10.0 113.285 171.929 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.9 m -70.3 -37.65 74.84 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 121.039 -1.038 . . . . 10.0 110.656 -179.67 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.475 HG22 ' HE1' ' A' ' 53' ' ' MET . 14.2 t -52.88 -53.63 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 124.043 0.937 . . . . 10.0 110.395 172.209 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HA ' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -59.16 -35.75 74.09 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.774 0.657 . . . . 10.0 112.774 176.629 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 63.2 m -72.19 -33.3 67.55 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 118.9 -0.571 . . . . 10.0 112.319 -179.378 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.86 85.1 0.5 Allowed Glycine 0 CA--C 1.533 1.17 0 CA-C-N 119.413 1.006 . . . . 10.0 111.215 -174.019 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.44 172.38 0.34 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.655 1.182 . . . . 10.0 111.523 170.307 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -46.85 -57.79 4.57 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.802 -1.186 . . . . 10.0 112.992 -170.767 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -102.13 28.26 5.97 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 113.647 -1.615 . . . . 10.0 110.585 -179.644 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 53' ' ' MET . . . . . 0.475 ' HE1' HG22 ' A' ' 46' ' ' VAL . 3.3 mmm -123.07 129.2 25.05 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.912 1.285 . . . . 10.0 112.484 179.553 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -68.87 157.34 62.23 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.739 2.293 . . . . 10.0 110.825 176.098 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -61.85 132.81 41.52 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.508 2.139 . . . . 10.0 109.31 -178.679 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.412 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 53.45 41.12 63.0 Favored Glycine 0 C--N 1.338 0.673 0 C-N-CA 121.504 -0.379 . . . . 10.0 112.929 -178.185 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.47 50.58 10.34 Favored Glycine 0 CA--C 1.532 1.121 0 N-CA-C 112.062 -0.415 . . . . 10.0 112.062 -179.514 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 65.05 36.72 7.19 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.762 1.625 . . . . 10.0 112.808 176.592 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.5 t -126.18 148.74 49.37 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.293 1.037 . . . . 10.0 111.543 175.319 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 25.4 m -81.54 -75.03 0.3 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.259 0.623 . . . . 10.0 111.048 179.407 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -114.27 41.8 2.21 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.879 1.272 . . . . 10.0 111.631 -175.348 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 7.1 m -61.43 136.57 58.08 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.152 -0.968 . . . . 10.0 110.833 171.248 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 28.6 m -107.13 159.04 16.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.985 1.714 . . . . 10.0 108.881 175.775 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -44.26 -43.7 7.49 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.219 1.192 . . . . 10.0 114.219 175.865 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -51.56 -38.03 52.43 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.084 0.401 . . . . 10.0 112.084 176.595 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.434 ' HB3' ' CD1' ' A' ' 6' ' ' ILE . 0.3 OUTLIER -85.41 -48.15 9.28 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.922 0.889 . . . . 10.0 111.131 177.039 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.11 -52.44 65.73 Favored 'General case' 0 C--N 1.34 0.157 0 O-C-N 121.338 -0.851 . . . . 10.0 111.572 -175.725 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -61.13 -53.16 60.51 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 -179.563 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.29 -37.12 10.19 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.238 0.829 . . . . 10.0 113.238 170.628 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.34 -43.22 77.96 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.095 -1.003 . . . . 10.0 112.373 179.901 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 21.8 pt -76.23 -35.34 27.72 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 O-C-N 121.34 -0.85 . . . . 10.0 112.729 177.254 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -67.92 -29.31 68.36 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.535 1.534 . . . . 10.0 111.843 171.56 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -54.35 -50.54 67.2 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.95 -1.093 . . . . 10.0 110.861 169.696 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 70.1 mtm -65.77 -65.09 0.72 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.595 0.358 . . . . 10.0 110.071 178.047 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.4 ' HB2' ' CE3' ' A' ' 31' ' ' TRP . 3.8 m -141.66 -87.4 0.16 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.055 -0.35 . . . . 10.0 110.055 175.507 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt 174.34 49.27 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.131 1.772 . . . . 10.0 110.855 -176.598 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -168.4 -83.97 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.563 1.319 . . . . 10.0 114.563 179.58 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.429 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.151 0 N-CA-C 114.457 1.28 . . . . 10.0 114.457 -170.639 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.867 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.976 0 CA-C-O 116.957 -1.497 . . . . 10.0 108.388 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -163.12 85.38 0.52 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 122.36 1.076 . . . . 10.0 111.416 -168.173 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.62 72.56 1.45 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.545 1.538 . . . . 10.0 110.159 174.999 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -114.28 -19.67 11.18 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 115.137 1.532 . . . . 10.0 115.137 175.684 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -161.81 167.91 24.04 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.498 1.519 . . . . 10.0 107.27 -173.553 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.38 -49.02 13.02 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.645 2.378 . . . . 10.0 112.183 172.862 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -58.3 -45.92 87.07 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-O 121.126 0.488 . . . . 10.0 110.599 -179.398 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.29 -34.38 77.85 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.04 -0.412 . . . . 10.0 109.962 -176.68 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.473 HD12 ' SG ' ' A' ' 62' ' ' CYS . 4.8 mm -66.45 -50.56 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 118.388 -0.815 . . . . 10.0 110.779 177.009 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.1 -39.26 86.7 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 117.011 -1.876 . . . . 10.0 111.048 179.29 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -69.17 -22.45 63.91 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.482 1.513 . . . . 10.0 113.099 -178.107 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.61 -29.13 16.3 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.138 0.975 . . . . 10.0 113.175 170.758 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.22 -64.63 1.27 Allowed 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.136 0.974 . . . . 10.0 112.667 -169.286 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.01 42.05 0.24 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.893 1.277 . . . . 10.0 110.896 177.834 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.2 t -126.65 -2.5 6.69 Favored 'General case' 0 CA--C 1.521 -0.146 0 C-N-CA 124.948 1.299 . . . . 10.0 114.067 -163.968 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.8 t -102.78 -52.52 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 124.019 0.928 . . . . 10.0 108.861 -174.256 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.3 m -81.14 -64.91 1.09 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.728 1.611 . . . . 10.0 110.471 175.806 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 28.8 m-70 -73.65 -13.03 60.93 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.01 1.324 . . . . 10.0 114.534 -163.936 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 t -73.51 -38.92 65.18 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.161 0.584 . . . . 10.0 110.658 -179.101 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.8 tpt -117.87 -34.32 4.22 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.899 1.279 . . . . 10.0 113.001 -177.039 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.9 52.62 2.06 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.687 1.613 . . . . 10.0 113.414 178.806 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 84.4 t -75.02 -56.15 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 O-C-N 121.702 -0.881 . . . . 10.0 112.585 -174.452 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.91 33.72 0.44 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.74 0.816 . . . . 10.0 111.038 -179.299 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 65.04 21.35 67.81 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 124.406 1.003 . . . . 10.0 112.606 -170.809 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.65 140.59 97.5 Favored Pre-proline 0 CA--C 1.546 0.806 0 N-CA-C 113.426 0.899 . . . . 10.0 113.426 -172.559 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -71.56 143.4 42.38 Favored 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 125.217 3.945 . . . . 10.0 111.038 -177.255 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -67.19 145.14 55.54 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.258 -0.901 . . . . 10.0 113.43 -166.136 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 79.0 p -41.03 -40.09 1.36 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.714 1.206 . . . . 10.0 113.442 161.499 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -133.06 122.84 24.73 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.939 1.296 . . . . 10.0 110.511 171.706 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -154.69 170.46 21.5 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.867 2.067 . . . . 10.0 107.727 172.58 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.3 m -110.61 -37.99 5.3 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.644 0.656 . . . . 10.0 111.93 169.366 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.83 -19.72 37.03 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 120.996 -1.065 . . . . 10.0 112.836 -175.946 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -79.1 -35.51 42.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.455 1.902 . . . . 10.0 110.133 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.495 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 70.5 m95 -88.48 -37.87 15.44 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.802 2.441 . . . . 10.0 112.736 -179.695 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -40.01 -59.96 1.6 Allowed Pre-proline 0 CA--C 1.545 0.773 0 N-CA-C 113.983 1.105 . . . . 10.0 113.983 173.696 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.65 22.13 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.073 3.182 . . . . 10.0 114.731 178.895 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.624 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -125.98 -47.27 1.65 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.288 1.835 . . . . 10.0 109.854 167.7 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.46 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 1.5 mt -54.81 -5.45 0.09 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.316 1.846 . . . . 10.0 114.154 168.142 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.35 -31.41 48.56 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.194 1.398 . . . . 10.0 109.792 178.245 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.3 mttp -91.31 -57.18 2.87 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.79 0.436 . . . . 10.0 110.515 169.531 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.66 -114.52 0.66 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.255 -0.738 . . . . 10.0 111.255 172.643 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -127.04 175.74 8.45 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.085 0 C-N-CA 125.529 1.531 . . . . 10.0 110.612 176.904 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.9 t70 73.45 -42.15 0.51 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.37 1.468 . . . . 10.0 112.138 -174.381 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -20.22 8.34 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.262 -0.899 . . . . 10.0 113.192 -176.353 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -103.51 -40.65 6.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.676 1.59 . . . . 10.0 111.572 178.988 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.513 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.4 OUTLIER -48.27 -35.52 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 124.622 1.169 . . . . 10.0 111.819 167.449 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -66.81 -43.48 83.69 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 120.528 -1.358 . . . . 10.0 114.065 169.115 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.5 m -72.34 -34.12 67.8 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.643 -1.286 . . . . 10.0 111.522 -176.962 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.513 HG12 ' HA ' ' A' ' 43' ' ' VAL . 9.9 p -68.03 -47.16 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 O-C-N 121.612 -0.68 . . . . 10.0 110.967 174.268 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -56.07 -41.97 75.93 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.112 0.414 . . . . 10.0 110.822 -179.904 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 32.7 p -72.86 -35.1 67.14 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.115 0.783 . . . . 10.0 113.115 178.491 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.15 105.59 0.85 Allowed Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.868 0.758 . . . . 10.0 112.562 -174.743 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.87 170.38 4.32 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.151 0.981 . . . . 10.0 111.621 171.053 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -52.04 -60.36 3.28 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.583 -1.323 . . . . 10.0 113.419 -169.268 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.51 15.85 1.92 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.692 1.197 . . . . 10.0 112.635 174.167 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.9 ttp -125.39 129.72 24.35 Favored Pre-proline 0 CA--C 1.547 0.84 0 N-CA-C 113.834 1.05 . . . . 10.0 113.834 -175.128 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.16 156.75 53.42 Favored 'Trans proline' 0 CA--C 1.538 0.721 0 C-N-CA 121.492 1.461 . . . . 10.0 111.636 178.758 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -57.48 139.26 89.61 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 122.408 2.072 . . . . 10.0 109.143 177.835 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.32 23.23 59.8 Favored Glycine 0 CA--C 1.528 0.858 0 C-N-CA 121.162 -0.542 . . . . 10.0 114.025 -174.378 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 49.66 37.27 26.83 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.278 1.039 . . . . 10.0 111.266 -174.272 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER 91.55 -27.13 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.487 2.315 . . . . 10.0 112.871 -176.478 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 19.3 t -95.46 69.82 3.07 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.087 -1.008 . . . . 10.0 113.048 -176.864 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.4 m -53.82 -22.06 8.82 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.263 -0.898 . . . . 10.0 113.03 170.322 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -78.57 -24.36 45.6 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 127.005 2.122 . . . . 10.0 112.785 -178.677 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' CYS . . . . . 0.473 ' SG ' HD12 ' A' ' 6' ' ' ILE . 66.4 m -70.66 144.95 50.92 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.988 -1.07 . . . . 10.0 112.938 -173.536 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 91.3 m -100.54 -91.09 0.31 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.412 0.551 . . . . 10.0 110.526 -174.394 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -152.45 -50.03 0.11 Allowed 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 124.702 1.201 . . . . 10.0 109.57 179.154 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -52.96 -57.84 8.96 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.342 -0.849 . . . . 10.0 112.844 175.625 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -74.16 -28.61 61.39 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.443 1.02 . . . . 10.0 110.23 -179.021 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.28 -53.81 38.49 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.566 1.146 . . . . 10.0 111.206 -177.327 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.0 pttp -62.67 -49.73 73.97 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 107.362 -1.347 . . . . 10.0 107.362 179.426 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.95 -34.94 57.85 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.118 0.567 . . . . 10.0 112.247 175.811 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.51 -49.82 72.02 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.644 -0.66 . . . . 10.0 110.684 177.718 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 7.0 mt -67.65 -40.83 84.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.347 0.594 . . . . 10.0 111.768 176.572 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -57.83 -37.29 73.57 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.928 1.291 . . . . 10.0 111.435 172.804 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -54.26 -44.63 71.97 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.733 0.642 . . . . 10.0 112.733 176.796 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.495 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 1.2 mpp? -69.19 -74.05 0.14 Allowed 'General case' 0 CA--C 1.541 0.613 0 O-C-N 122.095 -0.378 . . . . 10.0 111.902 179.274 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 t -161.0 37.76 0.15 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.246 0.619 . . . . 10.0 112.3 178.496 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.255 2.5 ptpt 42.51 55.36 4.17 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.554 1.942 . . . . 10.0 114.741 174.613 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.624 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -158.86 -87.4 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.505 -0.77 . . . . 10.0 112.372 178.437 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.543 ' HA ' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.033 0 N-CA-C 115.687 1.736 . . . . 10.0 115.687 -163.512 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.762 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.965 0 N-CA-C 108.514 -0.921 . . . . 10.0 108.514 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -164.47 105.11 0.85 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.911 0.862 . . . . 10.0 111.264 -144.424 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' -1' ' ' LEU . . . . . 0.481 HD12 HG13 ' A' ' 6' ' ' ILE . 1.6 tp -75.08 69.41 1.97 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.122 0.969 . . . . 10.0 110.257 174.846 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -110.19 -25.02 10.39 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.904 1.282 . . . . 10.0 112.221 174.83 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -147.03 112.69 5.66 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 124.028 0.931 . . . . 10.0 109.072 174.746 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -38.29 -41.64 0.63 Allowed 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.274 1.583 . . . . 10.0 115.274 166.155 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -58.04 -48.29 80.55 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.121 0.873 . . . . 10.0 110.404 171.399 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.22 -33.22 74.9 Favored 'General case' 0 N--CA 1.457 -0.122 0 O-C-N 121.795 -0.566 . . . . 10.0 110.37 -178.228 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.481 HG13 HD12 ' A' ' -1' ' ' LEU . 15.9 mm -65.84 -50.79 68.06 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-O 118.46 -0.781 . . . . 10.0 109.94 174.831 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.471 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -67.58 -40.39 84.83 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 117.379 -1.729 . . . . 10.0 111.15 -178.772 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -69.4 -22.68 63.68 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.971 1.708 . . . . 10.0 112.922 -178.704 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -92.69 -29.18 16.2 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.648 1.179 . . . . 10.0 113.206 170.663 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.92 -63.78 1.36 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.443 1.097 . . . . 10.0 112.734 -170.732 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.471 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.51 40.32 0.17 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.908 1.283 . . . . 10.0 111.131 178.962 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -127.6 1.57 6.17 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 114.254 1.205 . . . . 10.0 114.254 -164.158 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.7 t -96.75 -42.38 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 C-N-CA 124.918 1.287 . . . . 10.0 108.399 -179.139 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.2 m -105.33 -58.96 1.82 Allowed 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.666 1.986 . . . . 10.0 109.506 -169.428 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -74.26 -26.21 60.08 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.88 1.067 . . . . 10.0 113.88 -172.267 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.0 m -59.55 -47.86 83.9 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.415 0.686 . . . . 10.0 111.292 -177.961 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.6 tpt -106.83 -23.74 12.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.634 0.773 . . . . 10.0 111.932 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.04 57.99 1.63 Allowed Glycine 0 CA--C 1.535 1.323 0 C-N-CA 123.866 0.746 . . . . 10.0 112.234 -173.967 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 51.6 t -105.62 161.02 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 125.842 1.657 . . . . 10.0 109.518 -179.836 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 55.89 26.61 9.94 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.253 1.021 . . . . 10.0 112.693 -175.163 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.8 11.09 84.83 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.622 1.106 . . . . 10.0 113.944 -176.46 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.3 142.43 92.44 Favored Pre-proline 0 CA--C 1.548 0.87 0 CA-C-N 118.926 1.363 . . . . 10.0 113.761 -173.172 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -75.13 152.13 39.78 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 125.145 3.897 . . . . 10.0 110.529 -178.416 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.78 141.94 38.57 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -165.809 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.6 p -79.07 50.26 1.02 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.351 1.461 . . . . 10.0 113.43 -179.052 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -146.72 -39.71 0.21 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 115.623 1.712 . . . . 10.0 115.623 177.361 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.88 153.94 39.65 Favored 'General case' 0 C--O 1.226 -0.163 0 N-CA-C 108.211 -1.033 . . . . 10.0 108.211 179.289 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 34.1 m -96.13 -30.17 13.67 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 119.485 1.039 . . . . 10.0 110.267 174.251 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.39 -31.28 63.7 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.787 1.403 . . . . 10.0 114.787 -178.951 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -77.1 -31.41 55.84 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-O 121.792 0.806 . . . . 10.0 111.539 178.055 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.513 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 59.9 m95 -85.99 -33.6 21.04 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.119 2.167 . . . . 10.0 112.266 -178.265 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -46.94 -56.54 11.52 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.35 1.46 . . . . 10.0 113.424 175.5 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.35 14.97 0.21 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.321 2.681 . . . . 10.0 114.016 178.351 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.32 -52.65 2.48 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.014 1.726 . . . . 10.0 109.357 167.073 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.422 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -61.77 -19.2 62.22 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.642 1.577 . . . . 10.0 112.588 -179.204 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.13 -35.27 25.72 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 125.064 1.345 . . . . 10.0 109.601 -178.754 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -72.4 -50.36 27.0 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.175 171.12 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 162.68 -130.21 2.21 Favored Glycine 0 CA--C 1.533 1.177 0 N-CA-C 111.237 -0.745 . . . . 10.0 111.237 177.298 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.1 t -136.29 -58.84 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 123.753 0.821 . . . . 10.0 109.442 -178.01 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.67 11.08 0.06 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.607 1.963 . . . . 10.0 114.285 -177.701 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -96.43 -20.97 18.04 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 127.104 2.161 . . . . 10.0 110.837 178.577 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -100.26 -41.56 7.03 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.108 0.563 . . . . 10.0 111.352 -178.65 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -52.89 -35.71 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 CA-C-O 121.279 0.562 . . . . 10.0 111.188 172.564 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.3 ptmt -64.77 -43.75 92.25 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.954 1.094 . . . . 10.0 113.954 170.303 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.8 -36.7 81.87 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.017 -1.052 . . . . 10.0 109.78 177.128 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 23.0 t -60.1 -57.89 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.837 0 C-N-CA 123.067 0.547 . . . . 10.0 110.385 176.139 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -55.84 -34.53 65.5 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 112.885 0.698 . . . . 10.0 112.885 177.579 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.5 m -72.05 -35.94 69.47 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 176.014 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.61 109.74 0.54 Allowed Glycine 0 CA--C 1.536 1.384 0 CA-C-N 119.324 0.966 . . . . 10.0 112.16 -173.027 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.55 -174.45 3.39 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.304 1.042 . . . . 10.0 111.412 175.322 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -51.58 -55.37 19.55 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 123.317 1.532 . . . . 10.0 112.973 -167.165 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -113.14 34.2 4.62 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 111.575 -2.557 . . . . 10.0 108.915 -176.758 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 44.9 ttp -138.46 123.75 12.2 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 177.799 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -65.91 160.79 42.41 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 122.688 2.259 . . . . 10.0 111.963 -177.739 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -59.57 127.43 23.67 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.784 2.323 . . . . 10.0 109.891 -178.654 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.64 10.58 85.81 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 114.403 0.521 . . . . 10.0 114.403 -173.16 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 62.18 30.54 76.13 Favored Glycine 0 CA--C 1.54 1.624 0 CA-C-N 119.199 1.499 . . . . 10.0 112.697 -178.761 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 80.25 55.15 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.815 2.046 . . . . 10.0 111.549 176.137 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -127.69 167.24 16.72 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.907 1.683 . . . . 10.0 110.956 178.082 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.2 m -118.02 -89.28 0.59 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.861 0.864 . . . . 10.0 110.528 176.987 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -93.2 66.31 4.03 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.444 1.098 . . . . 10.0 109.148 -176.034 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 53.7 m -120.92 129.14 53.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.119 -0.946 . . . . 10.0 111.606 -170.744 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 81.2 m -125.64 145.77 50.01 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 123.666 0.786 . . . . 10.0 110.789 -172.597 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -32.75 -43.2 0.09 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 128.025 2.53 . . . . 10.0 113.932 176.71 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -28.58 -62.04 0.11 Allowed 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.839 2.056 . . . . 10.0 114.321 164.946 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.82 -28.19 12.58 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.489 1.116 . . . . 10.0 112.178 178.581 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -51.89 -41.58 62.05 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.826 -1.171 . . . . 10.0 112.085 170.753 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.424 ' HG3' ' N ' ' A' ' 69' ' ' ALA . 51.4 pttt -62.56 -55.7 24.78 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 107.744 -1.206 . . . . 10.0 107.744 175.681 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.424 ' N ' ' HG3' ' A' ' 68' ' ' LYS . . . -51.38 -33.22 29.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.809 0.844 . . . . 10.0 111.31 -179.71 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.37 -38.85 78.24 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 123.764 0.826 . . . . 10.0 111.749 -179.284 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 10.4 mt -79.4 -47.3 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.355 1.462 . . . . 10.0 111.036 174.937 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -48.25 -42.66 31.11 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 127.116 2.166 . . . . 10.0 112.049 171.428 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -44.41 -44.47 8.39 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.648 0.779 . . . . 10.0 112.185 175.882 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.499 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 3.2 mpp? -75.32 -70.7 0.41 Allowed 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.696 0.284 . . . . 10.0 111.435 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -161.71 32.59 0.13 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.155 0.798 . . . . 10.0 113.155 -178.923 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 39.42 55.36 2.3 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.088 1.355 . . . . 10.0 113.577 -179.098 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.444 ' HB3' ' HE3' ' A' ' 31' ' ' TRP . . . -140.08 -61.85 0.52 Allowed 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.532 -0.758 . . . . 10.0 112.372 178.78 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.513 ' HE3' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.731 0 N-CA-C 115.202 1.556 . . . . 10.0 115.202 -163.967 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.835 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 117.066 -1.445 . . . . 10.0 108.85 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -160.85 44.6 0.18 Allowed 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 123.381 1.562 . . . . 10.0 108.994 179.619 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -146.0 74.18 1.37 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 127.28 2.232 . . . . 10.0 107.878 -178.375 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.38 -20.79 10.14 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.131 1.16 . . . . 10.0 114.131 171.677 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -156.61 159.87 38.88 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.529 1.532 . . . . 10.0 107.356 -174.95 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.51 -41.96 26.25 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 128.061 2.545 . . . . 10.0 112.082 179.116 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -57.14 -48.6 78.28 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 121.428 0.632 . . . . 10.0 109.702 175.011 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.91 -33.86 76.51 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.345 -175.63 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.0 mt -65.2 -52.22 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 CA-C-O 118.798 -0.62 . . . . 10.0 109.699 176.221 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.42 -38.12 80.92 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 117.142 -1.823 . . . . 10.0 111.313 -177.975 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -69.22 -22.48 63.87 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.69 1.596 . . . . 10.0 113.134 -179.438 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.94 -28.41 14.69 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.999 0.92 . . . . 10.0 113.241 170.631 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.1 -66.33 1.08 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.439 1.096 . . . . 10.0 112.474 -171.187 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.15 43.24 0.21 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 124.781 1.232 . . . . 10.0 111.127 178.12 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.8 t -129.24 -6.62 4.83 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 125.195 1.398 . . . . 10.0 113.816 -164.886 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.6 t -94.79 -43.98 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 124.052 0.941 . . . . 10.0 108.781 -175.245 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.0 m -104.43 -54.55 2.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 125.671 1.589 . . . . 10.0 109.257 -169.713 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -73.59 -13.41 61.01 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.351 1.46 . . . . 10.0 114.081 -172.896 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.3 t -73.01 -43.25 62.36 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.77 -0.581 . . . . 10.0 110.494 -178.144 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 16.3 tpp -112.18 -37.5 5.02 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.936 1.294 . . . . 10.0 112.999 179.917 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.98 58.98 1.27 Allowed Glycine 0 CA--C 1.534 1.268 0 C-N-CA 125.236 1.398 . . . . 10.0 113.461 -178.591 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 89.7 t -79.8 -60.28 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.615 -0.932 . . . . 10.0 112.711 -175.431 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.47 30.74 0.41 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.716 0.806 . . . . 10.0 111.171 178.884 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.57 6.69 81.72 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 124.348 0.975 . . . . 10.0 113.58 -173.466 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.43 135.83 69.97 Favored Pre-proline 0 CA--C 1.544 0.732 0 CA-C-N 118.07 0.935 . . . . 10.0 112.529 -176.272 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -69.36 149.83 69.93 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.917 3.078 . . . . 10.0 111.111 -175.335 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.63 134.48 39.3 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.156 0.583 . . . . 10.0 110.871 -163.985 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 94.8 p -39.7 -41.33 1.06 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.006 1.323 . . . . 10.0 114.1 178.142 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 26.6 p-80 -131.94 113.64 13.67 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.033 1.733 . . . . 10.0 109.701 173.094 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -149.53 162.19 40.64 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.927 1.691 . . . . 10.0 107.682 174.167 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 99.5 m -107.53 -37.08 6.29 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.596 0.635 . . . . 10.0 111.686 170.127 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.36 -24.94 39.45 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 121.188 -0.945 . . . . 10.0 112.629 -176.76 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -77.33 -39.0 49.19 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.699 1.6 . . . . 10.0 108.947 177.879 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.461 ' CH2' ' HG3' ' A' ' 78' ' ' LYS . 60.1 m95 -80.87 -34.83 33.39 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.21 1.804 . . . . 10.0 112.427 179.568 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -40.18 -61.1 1.23 Allowed Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 115.033 1.494 . . . . 10.0 115.033 172.798 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -68.42 -4.67 13.38 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.333 2.689 . . . . 10.0 113.897 -179.014 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.0 -47.97 6.74 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.124 0.97 . . . . 10.0 108.652 172.234 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.72 16.76 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.83 1.652 . . . . 10.0 115.277 171.699 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.01 -24.05 22.45 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 120.99 -1.069 . . . . 10.0 110.835 -178.071 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.7 mptt -101.16 -48.78 4.29 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.024 0.93 . . . . 10.0 109.868 173.632 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.5 -124.73 1.85 Allowed Glycine 0 CA--C 1.528 0.855 0 N-CA-C 110.412 -1.075 . . . . 10.0 110.412 172.928 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -117.41 175.48 3.25 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.132 0 C-N-CA 125.316 1.446 . . . . 10.0 110.581 175.601 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 70.79 -45.04 0.6 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.078 1.751 . . . . 10.0 112.035 -174.868 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -44.0 -37.59 3.05 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.503 1.047 . . . . 10.0 111.928 -177.424 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -81.03 -43.6 19.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 125.677 1.591 . . . . 10.0 112.227 -179.715 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.81 -31.7 47.97 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 CA-C-O 121.545 0.688 . . . . 10.0 110.09 175.68 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -60.64 -51.06 70.98 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.579 -0.701 . . . . 10.0 112.284 169.871 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 54.1 m -62.28 -35.8 80.13 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 121.128 -0.983 . . . . 10.0 110.296 178.322 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.6 t -61.77 -54.8 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 C-N-CA 123.246 0.618 . . . . 10.0 111.294 177.413 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.72 -36.28 67.06 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 111.928 0.344 . . . . 10.0 111.928 177.059 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 50.0 m -72.37 -40.9 66.95 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.29 0.636 . . . . 10.0 112.566 178.26 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.32 114.86 0.77 Allowed Glycine 0 CA--C 1.528 0.861 0 N-CA-C 111.048 -0.821 . . . . 10.0 111.048 -168.103 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.91 -163.68 0.11 Allowed 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.436 0.695 . . . . 10.0 110.374 169.199 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -71.06 -62.58 1.34 Allowed 'General case' 0 N--CA 1.471 0.584 0 O-C-N 119.839 -1.788 . . . . 10.0 111.353 -172.445 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.74 -14.93 60.34 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.894 1.278 . . . . 10.0 112.586 173.717 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.8 ttp -102.69 120.79 51.73 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 123.181 0.592 . . . . 10.0 112.134 -172.582 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.33 155.26 70.85 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.079 1.852 . . . . 10.0 112.128 -173.183 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -57.94 130.21 37.14 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.373 2.715 . . . . 10.0 110.461 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.53 29.83 75.44 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 118.458 -1.19 . . . . 10.0 113.968 -172.4 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.4 29.3 3.75 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-N 118.984 1.392 . . . . 10.0 115.688 168.703 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.1 ttt 62.5 35.41 14.64 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.271 1.828 . . . . 10.0 114.195 -173.5 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.7 t -123.91 70.02 1.07 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.763 2.025 . . . . 10.0 109.427 -178.28 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 72.7 p 11.55 -96.42 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 128.82 2.848 . . . . 10.0 115.675 -178.826 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -125.7 54.87 1.47 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.913 1.285 . . . . 10.0 109.475 173.541 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 84.1 m -69.67 134.99 49.33 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.337 -0.852 . . . . 10.0 112.503 -178.655 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.59 140.39 33.86 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.622 1.169 . . . . 10.0 110.069 -178.184 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -39.27 -37.11 0.39 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.666 1.986 . . . . 10.0 113.496 176.711 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -36.39 -59.74 0.62 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.549 1.54 . . . . 10.0 113.539 166.147 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -97.59 -25.43 15.14 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.581 0.752 . . . . 10.0 110.992 179.762 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -54.18 48.96 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 120.826 -1.171 . . . . 10.0 110.612 176.276 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -61.83 -40.63 95.97 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.967 0.907 . . . . 10.0 110.219 -176.426 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -57.89 -30.75 66.12 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.949 -0.47 . . . . 10.0 111.735 171.007 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.77 -40.25 33.74 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 120.781 -1.199 . . . . 10.0 110.526 -173.001 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -43.03 78.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 122.799 0.439 . . . . 10.0 111.055 172.801 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -30.96 71.84 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.524 -0.735 . . . . 10.0 111.636 179.286 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -51.05 -48.23 61.58 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.873 -0.517 . . . . 10.0 112.241 171.454 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -64.51 -47.24 79.64 Favored 'General case' 0 CA--C 1.532 0.26 0 O-C-N 121.734 -0.604 . . . . 10.0 111.496 174.073 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.9 t -164.28 -78.18 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 120.28 -0.568 . . . . 10.0 111.72 175.98 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.3 pttt 163.09 45.03 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.659 2.784 . . . . 10.0 109.501 -176.624 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -152.45 -81.05 0.1 Allowed 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 114.528 1.307 . . . . 10.0 114.528 166.617 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.461 ' HG3' ' CH2' ' A' ' 31' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.254 1.299 0 N-CA-C 117.347 2.351 . . . . 10.0 117.347 -165.816 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.828 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 109.47 -0.567 . . . . 10.0 109.47 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -162.01 123.23 2.69 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.532 0.733 . . . . 10.0 110.232 -173.28 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' -1' ' ' LEU . . . . . 0.435 HD12 HG13 ' A' ' 6' ' ' ILE . 0.3 OUTLIER -74.77 72.56 2.03 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.598 1.189 . . . . 10.0 109.184 173.754 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -106.65 -26.74 11.21 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 125.556 1.542 . . . . 10.0 111.443 179.422 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -143.62 115.11 8.08 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 123.666 0.786 . . . . 10.0 109.177 172.02 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.417 ' HB1' ' N ' ' A' ' 70' ' ' ALA . . . -43.87 -36.99 2.6 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.2 1.185 . . . . 10.0 114.2 167.997 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -54.49 -50.81 66.9 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 118.716 0.689 . . . . 10.0 110.468 170.533 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.74 -34.12 76.21 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 121.878 -0.513 . . . . 10.0 110.173 -175.638 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.435 HG13 HD12 ' A' ' -1' ' ' LEU . 22.2 mm -66.23 -51.05 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-O 118.041 -0.981 . . . . 10.0 110.113 176.42 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.405 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -67.59 -40.11 84.79 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 117.353 -1.739 . . . . 10.0 111.115 -179.916 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -69.07 -22.54 64.01 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.362 1.465 . . . . 10.0 112.637 -176.424 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -97.11 -26.66 14.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.443 1.097 . . . . 10.0 113.572 170.863 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -103.26 -68.35 0.84 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.954 1.302 . . . . 10.0 113.042 -175.599 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.405 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.65 41.99 0.28 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.469 1.508 . . . . 10.0 110.837 -178.476 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.4 t -126.76 -0.38 6.71 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 124.596 1.158 . . . . 10.0 113.52 -163.683 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 t -104.11 -53.14 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 C-N-CA 125.047 1.339 . . . . 10.0 108.573 -174.609 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.7 m -80.34 -65.8 0.96 Allowed 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.213 1.805 . . . . 10.0 110.192 176.333 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -72.91 -15.75 61.57 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.648 1.179 . . . . 10.0 113.983 -164.425 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.1 t -69.57 -41.24 76.09 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.827 -0.545 . . . . 10.0 110.829 -178.139 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.6 tpt -117.66 -35.76 3.86 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.889 1.276 . . . . 10.0 112.893 -177.468 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.89 56.46 1.31 Allowed Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.199 1.38 . . . . 10.0 113.693 179.927 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 64.0 t -78.49 -55.17 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 O-C-N 121.769 -0.842 . . . . 10.0 112.763 -176.046 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.05 32.83 0.44 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.739 0.815 . . . . 10.0 111.339 -179.076 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 62.0 32.21 81.37 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 123.926 0.774 . . . . 10.0 111.859 -169.914 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.65 148.23 82.39 Favored Pre-proline 0 CA--C 1.543 0.677 0 C-N-CA 123.656 0.782 . . . . 10.0 111.794 179.798 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -71.58 155.04 59.78 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 124.624 3.549 . . . . 10.0 110.481 -179.175 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -79.5 136.63 36.96 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.753 -0.592 . . . . 10.0 111.183 -172.525 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.7 m -37.13 -35.84 0.12 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.783 1.633 . . . . 10.0 114.67 169.742 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.4 p80 -131.81 117.44 18.55 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.374 1.07 . . . . 10.0 109.425 171.268 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.464 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . 3.2 m-20 -153.33 162.46 41.26 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 106.593 -1.632 . . . . 10.0 106.593 170.858 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 86.9 m -110.43 -36.35 5.8 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 118.21 0.459 . . . . 10.0 111.642 168.552 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.86 -25.24 37.81 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.289 -0.882 . . . . 10.0 113.046 -175.797 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' ASP . . . . . 0.464 ' HB3' ' HB3' ' A' ' 27' ' ' ASN . 65.1 t0 -79.18 -31.48 43.89 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.983 1.713 . . . . 10.0 109.383 176.057 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.49 ' CH2' ' HG3' ' A' ' 78' ' ' LYS . 56.7 m95 -84.02 -34.76 24.23 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.813 1.245 . . . . 10.0 111.285 179.481 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.85 -58.99 2.8 Favored Pre-proline 0 CA--C 1.551 0.984 0 N-CA-C 114.415 1.265 . . . . 10.0 114.415 173.451 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -73.72 6.79 2.64 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.33 2.687 . . . . 10.0 114.065 -178.784 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.603 HH12 ' CGD' ' A' ' 90' ' ' HEC . 0.0 OUTLIER -104.74 -42.0 5.51 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.981 0.912 . . . . 10.0 108.67 169.659 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.89 22.1 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 115.159 1.54 . . . . 10.0 115.159 164.73 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.18 -36.96 14.49 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 120.955 -1.091 . . . . 10.0 110.023 178.768 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -76.35 -54.94 6.04 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.977 174.005 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 136.37 50.76 0.07 OUTLIER Glycine 0 CA--C 1.534 1.261 0 CA-C-O 119.334 -0.703 . . . . 10.0 114.808 168.483 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.9 t 62.03 165.36 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.861 1.264 . . . . 10.0 111.906 -179.67 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 77.41 -50.96 0.54 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.417 1.487 . . . . 10.0 110.738 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -38.23 -41.08 0.57 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.655 1.182 . . . . 10.0 111.942 172.091 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.408 ' HB3' ' CMA' ' A' ' 90' ' ' HEC . 1.3 mm? -68.37 -50.89 49.95 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 124.596 1.158 . . . . 10.0 111.293 -179.436 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.57 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.4 OUTLIER -50.45 -29.29 6.28 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 C-N-CA 124.321 1.049 . . . . 10.0 112.357 167.541 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.509 ' HE3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -81.67 -37.36 27.55 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 120.676 -1.265 . . . . 10.0 114.362 173.64 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.5 m -76.0 -16.9 59.89 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.451 1.1 . . . . 10.0 111.421 173.767 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.57 HG12 ' HA ' ' A' ' 43' ' ' VAL . 4.5 p -89.05 -41.23 13.82 Favored 'Isoleucine or valine' 0 C--N 1.34 0.167 0 O-C-N 121.666 -0.646 . . . . 10.0 111.801 175.119 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.411 ' HA ' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -53.11 -39.3 63.32 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.91 0.862 . . . . 10.0 110.942 177.315 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.5 t -73.34 -39.1 65.48 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.277 1.431 . . . . 10.0 112.243 178.256 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 82.5 99.84 0.47 Allowed Glycine 0 CA--C 1.532 1.124 0 C-N-CA 123.36 0.505 . . . . 10.0 111.99 -174.961 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.6 tp -58.56 168.88 1.03 Allowed 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.947 -0.737 . . . . 10.0 111.693 170.026 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -46.96 -57.96 4.45 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.531 1.532 . . . . 10.0 113.547 -174.336 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.69 14.77 7.87 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 114.367 -1.288 . . . . 10.0 112.538 177.138 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -110.96 153.51 43.78 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 114.795 1.406 . . . . 10.0 114.795 171.678 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -72.58 154.13 54.88 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.564 2.176 . . . . 10.0 110.737 169.327 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -62.09 132.41 39.09 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.641 2.227 . . . . 10.0 108.408 175.783 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.411 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 63.11 30.21 76.79 Favored Glycine 0 C--N 1.338 0.648 0 C-N-CA 118.946 -1.597 . . . . 10.0 112.357 179.697 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.57 32.28 2.8 Favored Glycine 0 CA--C 1.541 1.668 0 CA-C-N 118.076 0.938 . . . . 10.0 113.987 -179.121 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.1 ttt 70.19 44.42 0.76 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.019 1.728 . . . . 10.0 113.224 -176.438 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.07 156.32 40.17 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.99 1.316 . . . . 10.0 111.572 178.555 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 49.0 m -112.16 -91.97 0.48 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.275 1.03 . . . . 10.0 109.74 -179.257 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -89.8 66.53 7.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.875 1.27 . . . . 10.0 109.52 178.625 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 62.7 m -117.96 127.24 53.64 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.558 1.143 . . . . 10.0 111.429 -176.126 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 85.6 m -122.57 146.14 47.7 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.75 0.82 . . . . 10.0 109.927 -173.129 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -37.26 -42.45 0.46 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.983 2.113 . . . . 10.0 113.43 -178.406 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -35.87 -53.2 0.74 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.263 1.425 . . . . 10.0 113.905 172.296 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.56 -33.51 10.29 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.741 0.816 . . . . 10.0 111.655 173.823 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.04 -40.13 57.53 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.616 -1.302 . . . . 10.0 112.043 177.981 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.2 pttt -69.1 -48.25 63.09 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 123.387 0.675 . . . . 10.0 109.972 178.053 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.25 -32.34 62.25 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.374 0.534 . . . . 10.0 111.802 175.102 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.417 ' N ' ' HB1' ' A' ' 3' ' ' ALA . . . -67.54 -42.45 82.68 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.985 0.914 . . . . 10.0 109.934 -178.76 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -67.92 -51.83 45.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 125.999 1.72 . . . . 10.0 111.773 173.193 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -58.81 -32.7 69.6 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.236 1.415 . . . . 10.0 111.966 178.057 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -47.3 -50.46 21.59 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.275 0.488 . . . . 10.0 111.845 175.987 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.459 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.2 mpp? -66.73 -45.71 77.79 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.966 0.358 . . . . 10.0 111.966 179.002 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.2 t -162.59 -71.48 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.015 0.526 . . . . 10.0 111.567 176.712 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.2 pttt 160.43 50.11 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.38 2.672 . . . . 10.0 110.972 -175.097 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.1 -80.95 0.05 OUTLIER 'General case' 0 C--O 1.224 -0.282 0 O-C-N 121.271 -0.893 . . . . 10.0 113.043 171.711 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.49 ' HG3' ' CH2' ' A' ' 31' ' ' TRP . 6.4 ptpp? . . . . . 0 C--O 1.251 1.158 0 N-CA-C 114.832 1.419 . . . . 10.0 114.832 -178.584 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.864 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 117.952 -1.023 . . . . 10.0 109.355 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -159.53 127.75 4.98 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.659 0.663 . . . . 10.0 109.797 -155.666 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' -1' ' ' LEU . . . . . 0.47 ' HA ' HD11 ' A' ' 6' ' ' ILE . 0.5 OUTLIER -74.03 72.04 1.63 Allowed 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.27 1.033 . . . . 10.0 110.303 179.731 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -112.64 -21.58 11.19 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.194 1.798 . . . . 10.0 114.313 178.276 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.425 ' C ' HD13 ' A' ' 6' ' ' ILE . 23.1 t70 -134.81 -129.49 0.16 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.591 1.556 . . . . 10.0 111.28 -167.518 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.7 -52.2 0.15 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 129.977 3.311 . . . . 10.0 109.112 -173.77 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -57.67 -49.28 77.02 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 121.441 0.639 . . . . 10.0 110.154 174.35 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.61 -30.9 70.61 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.902 -0.499 . . . . 10.0 110.775 -176.11 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.47 HD11 ' HA ' ' A' ' -1' ' ' LEU . 1.7 mp -67.95 -51.5 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 N-CA-C 108.678 -0.86 . . . . 10.0 108.678 -179.835 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.36 -42.84 78.62 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 119.625 -0.83 . . . . 10.0 110.837 178.811 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -67.35 -22.4 65.59 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.002 1.321 . . . . 10.0 111.94 -176.13 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.77 -30.81 16.81 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.015 1.117 . . . . 10.0 114.015 167.303 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.03 -65.64 1.14 Allowed 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.893 1.224 . . . . 10.0 113.147 -171.094 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.28 43.83 0.31 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.146 1.378 . . . . 10.0 110.175 178.412 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.9 t -124.63 -3.25 7.82 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 125.076 1.35 . . . . 10.0 113.803 -166.254 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -103.2 -48.11 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 124.312 1.045 . . . . 10.0 108.554 -174.268 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.4 m -85.09 -66.28 0.91 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.748 1.619 . . . . 10.0 110.757 174.157 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -73.87 -19.37 60.74 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.824 1.416 . . . . 10.0 114.824 -163.22 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.2 t -64.79 -54.83 25.02 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.038 0.535 . . . . 10.0 111.035 175.543 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.7 tpt -97.0 -20.16 18.26 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.725 0.81 . . . . 10.0 112.747 -177.841 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.58 42.67 6.4 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 125.563 1.554 . . . . 10.0 112.3 -173.665 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 15.3 t -81.01 159.28 4.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 O-C-N 121.693 -0.886 . . . . 10.0 109.146 176.505 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.53 19.84 5.65 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.914 1.286 . . . . 10.0 113.37 -174.939 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.6 24.35 76.34 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 123.906 0.765 . . . . 10.0 113.127 -173.476 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.43 145.32 87.67 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 118.596 1.198 . . . . 10.0 113.533 -177.782 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.473 ' HD3' HBD2 ' A' ' 90' ' ' HEC . 86.5 Cg_endo -75.17 145.9 31.41 Favored 'Trans proline' 0 N--CA 1.454 -0.828 1 C-N-CA 125.512 4.142 . . . . 10.0 109.825 -179.993 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -66.77 152.41 45.56 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-O 122.354 1.073 . . . . 10.0 112.137 -167.048 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.6 p -49.26 -33.18 12.27 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.721 1.608 . . . . 10.0 112.592 167.426 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -142.1 74.14 1.44 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.151 1.38 . . . . 10.0 111.947 -177.335 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 15.5 m-20 -103.41 166.27 10.53 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.767 1.227 . . . . 10.0 108.927 166.928 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.5 t -110.19 -36.03 5.94 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 166.979 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.87 -23.92 41.57 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.654 -1.279 . . . . 10.0 112.535 -176.86 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -79.21 -29.79 42.98 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.165 1.386 . . . . 10.0 110.509 178.455 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.465 ' HE3' ' HB3' ' A' ' 77' ' ' ALA . 57.7 m95 -89.64 -38.59 13.8 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.322 1.849 . . . . 10.0 111.091 -179.495 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -39.43 -61.97 0.9 Allowed Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 114.709 1.374 . . . . 10.0 114.709 174.961 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.04 -1.82 9.35 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.353 2.702 . . . . 10.0 113.862 -177.572 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 56.1 mmt-85 -98.9 -47.31 5.32 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.486 1.514 . . . . 10.0 108.695 176.665 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.15 -10.16 4.12 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 126.227 1.811 . . . . 10.0 113.656 172.762 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.81 -27.74 58.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.17 1.388 . . . . 10.0 109.503 178.179 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -92.96 -56.87 2.83 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.856 0.463 . . . . 10.0 110.51 169.412 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 165.47 -122.39 1.07 Allowed Glycine 0 CA--C 1.529 0.928 0 N-CA-C 111.567 -0.613 . . . . 10.0 111.567 179.864 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.3 p -151.4 -56.42 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 117.719 0.759 . . . . 10.0 111.352 -178.777 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.07 1.78 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.999 1.481 . . . . 10.0 114.999 171.748 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -69.7 -59.39 2.98 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.085 -1.009 . . . . 10.0 109.806 164.824 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.56 ' HB3' HMA2 ' A' ' 90' ' ' HEC . 2.9 mp -80.09 -20.89 44.05 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.38 -0.825 . . . . 10.0 111.042 -166.436 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.437 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.4 OUTLIER -59.13 -15.68 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 124.285 1.034 . . . . 10.0 112.452 164.005 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -82.57 -35.21 27.36 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.086 -1.009 . . . . 10.0 111.819 168.15 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 7.8 t -69.69 -44.77 69.73 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 123.481 0.713 . . . . 10.0 110.277 177.663 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' VAL . . . . . 0.437 HG12 ' HA ' ' A' ' 43' ' ' VAL . 3.6 p -58.58 -41.61 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 123.24 0.616 . . . . 10.0 111.632 -179.148 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.407 ' NZ ' ' OD1' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -70.88 -28.51 64.61 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.966 -0.459 . . . . 10.0 111.781 179.505 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.3 m -76.23 -35.09 59.18 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.865 1.266 . . . . 10.0 112.507 172.656 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.72 105.05 0.3 Allowed Glycine 0 CA--C 1.525 0.684 0 C-N-CA 123.727 0.679 . . . . 10.0 111.873 -170.345 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.4 tp -68.07 174.51 3.77 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 122.095 -0.65 . . . . 10.0 110.252 170.338 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -49.57 -54.75 16.44 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.598 -1.314 . . . . 10.0 113.138 -172.67 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -88.78 16.02 7.44 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.398 1.479 . . . . 10.0 112.95 175.76 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -122.98 142.96 39.42 Favored Pre-proline 0 CA--C 1.545 0.784 0 N-CA-C 115.024 1.49 . . . . 10.0 115.024 175.955 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.64 139.92 41.86 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 121.885 1.723 . . . . 10.0 110.835 177.171 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -60.95 119.91 7.33 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.938 2.425 . . . . 10.0 109.582 177.187 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.402 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 86.93 12.65 68.08 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 119.625 -1.274 . . . . 10.0 112.643 -175.343 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 60.29 14.6 34.24 Favored Glycine 0 CA--C 1.54 1.614 0 CA-C-N 119.478 1.639 . . . . 10.0 114.579 171.415 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.4 ttt 41.82 45.62 3.18 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.445 2.298 . . . . 10.0 114.525 -175.357 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.8 p -115.56 24.86 11.23 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.628 1.171 . . . . 10.0 113.388 178.63 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.6 m 65.0 -127.97 0.35 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.699 0.8 . . . . 10.0 110.422 177.087 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -79.29 60.0 2.98 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.826 1.25 . . . . 10.0 110.999 -179.304 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 2.8 m -60.9 96.34 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.995 0.918 . . . . 10.0 112.076 -177.452 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.3 t -88.46 129.66 35.38 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 121.072 -1.017 . . . . 10.0 108.386 176.672 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.407 ' OD1' ' NZ ' ' A' ' 47' ' ' LYS . 5.8 m-20 -38.83 -38.5 0.43 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.979 1.712 . . . . 10.0 113.137 178.514 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -43.4 -59.44 2.13 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.264 1.425 . . . . 10.0 112.23 169.183 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -80.7 -37.4 30.73 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.965 0.888 . . . . 10.0 110.344 -179.231 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.6 -46.88 73.89 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.394 1.078 . . . . 10.0 111.161 -179.3 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.8 pttt -72.77 -47.61 45.25 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 124.386 1.074 . . . . 10.0 108.869 -179.639 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.63 -41.1 21.27 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.73 0.412 . . . . 10.0 111.791 173.727 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.76 -53.78 53.16 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.224 0.609 . . . . 10.0 111.237 179.758 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 31.7 pt -71.65 -31.5 42.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 O-C-N 120.961 -1.087 . . . . 10.0 112.84 179.579 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -58.24 -40.45 81.77 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.409 0.684 . . . . 10.0 111.352 167.478 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -51.82 -43.76 63.25 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.508 0.559 . . . . 10.0 112.508 177.165 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -70.37 0.27 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.909 0.337 . . . . 10.0 111.909 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.2 t -162.45 31.56 0.11 Allowed 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.833 0.679 . . . . 10.0 112.833 -178.973 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.4 ptpt 35.58 51.1 0.64 Allowed 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 115.624 1.713 . . . . 10.0 115.624 178.786 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.465 ' HB3' ' HE3' ' A' ' 31' ' ' TRP . . . -132.17 -49.82 0.94 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.629 0.974 . . . . 10.0 113.629 -176.092 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.9 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 12.7 pttp . . . . . 0 C--O 1.249 1.049 0 CA-C-O 116.606 -1.664 . . . . 10.0 112.08 -177.266 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.9 HMA3 ' HB2' ' A' ' 78' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 110.168 -0.308 . . . . 10.0 110.168 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -161.06 119.95 2.53 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.524 0.73 . . . . 10.0 110.158 -169.45 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.13 65.27 1.49 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.386 0.674 . . . . 10.0 109.722 176.193 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -111.75 -27.71 8.39 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.4 1.48 . . . . 10.0 112.759 176.54 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -152.0 114.58 4.58 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 121.951 0.882 . . . . 10.0 109.32 174.98 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.481 ' HB1' ' N ' ' A' ' 70' ' ' ALA . . . -56.25 -28.25 57.86 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 114.212 1.19 . . . . 10.0 114.212 174.31 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -56.24 -48.33 76.72 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 119.093 0.86 . . . . 10.0 110.426 166.812 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 -34.55 76.48 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.792 -0.568 . . . . 10.0 110.176 -178.019 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.2 mm -65.49 -51.17 66.8 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 CA-C-O 118.871 -0.585 . . . . 10.0 109.668 176.939 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.454 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -68.11 -41.1 82.29 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 118.176 -1.41 . . . . 10.0 111.014 -178.899 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -69.05 -22.28 64.04 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.363 1.465 . . . . 10.0 112.755 -178.06 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.45 -29.07 16.45 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.31 1.044 . . . . 10.0 113.554 168.559 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.3 -65.08 1.19 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.806 1.185 . . . . 10.0 112.952 -172.192 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.454 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -74.46 39.74 0.13 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.542 1.537 . . . . 10.0 111.322 178.655 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.7 t -126.71 3.34 6.74 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 125.084 1.353 . . . . 10.0 113.676 -165.16 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.3 t -100.91 -38.72 6.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 124.604 1.162 . . . . 10.0 108.685 -177.355 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.3 m -110.28 -58.73 2.03 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 126.263 1.825 . . . . 10.0 109.65 -170.275 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 26.3 m-70 -73.48 -25.7 60.58 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.289 0.848 . . . . 10.0 113.289 -173.394 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.18 -51.27 64.9 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.903 0.881 . . . . 10.0 110.499 -177.393 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -111.44 -23.29 10.84 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.771 1.228 . . . . 10.0 112.358 -177.878 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.83 59.96 1.16 Allowed Glycine 0 CA--C 1.537 1.44 0 C-N-CA 124.381 0.991 . . . . 10.0 112.518 -175.513 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 25.6 t -104.74 159.65 5.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 125.515 1.526 . . . . 10.0 109.638 178.237 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.54 23.08 10.41 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.441 1.096 . . . . 10.0 113.178 -176.08 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.24 10.06 86.46 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.304 0.954 . . . . 10.0 113.468 -174.441 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.51 149.62 98.26 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 118.622 1.211 . . . . 10.0 111.451 179.087 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -76.41 163.94 31.5 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 123.859 3.039 . . . . 10.0 110.09 -177.398 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -71.31 141.04 50.49 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.589 -0.694 . . . . 10.0 111.776 -178.087 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.7 t -35.63 -37.79 0.1 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 127.233 2.213 . . . . 10.0 114.327 171.444 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.4 p-80 -139.57 118.43 12.46 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 108.106 -1.072 . . . . 10.0 108.106 168.812 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -138.19 161.2 37.45 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.299 -1.371 . . . . 10.0 107.299 168.793 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.7 t -106.55 -33.24 7.74 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 117.514 0.143 . . . . 10.0 111.255 169.335 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.84 -36.1 70.07 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 120.412 -1.43 . . . . 10.0 113.485 -179.941 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -80.54 -21.87 41.39 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.033 0.533 . . . . 10.0 110.908 -178.314 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 62.9 m95 -93.87 -34.88 12.96 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.659 1.583 . . . . 10.0 109.945 -178.21 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -41.39 -63.02 0.89 Allowed Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 124.786 1.234 . . . . 10.0 114.296 175.003 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -73.24 5.42 3.15 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.86 2.373 . . . . 10.0 113.975 -178.224 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -106.37 -44.08 4.61 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.476 1.91 . . . . 10.0 109.463 174.081 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.25 12.21 0.47 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.755 2.022 . . . . 10.0 113.191 173.764 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.94 -27.69 28.35 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 125.124 1.369 . . . . 10.0 109.914 177.649 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -90.93 -56.78 3.05 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.142 0.577 . . . . 10.0 110.831 175.218 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 150.32 -124.78 1.81 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 110.949 -0.86 . . . . 10.0 110.949 175.748 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -126.23 177.55 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 125.528 1.531 . . . . 10.0 110.041 176.335 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.49 ' HA ' HG12 ' A' ' 43' ' ' VAL . 7.6 t70 73.8 -43.55 0.55 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.779 1.231 . . . . 10.0 111.614 -171.249 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.32 -48.7 65.28 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 120.691 -1.256 . . . . 10.0 112.537 -174.028 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.7 mt -88.54 -37.67 15.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.603 1.161 . . . . 10.0 111.011 -173.513 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.49 HG12 ' HA ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER -58.26 -29.19 36.96 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.426 0.631 . . . . 10.0 110.382 171.699 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.4 mtpt -63.86 -52.48 59.85 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 120.395 -1.441 . . . . 10.0 114.243 168.884 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.23 -33.12 70.62 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.155 -0.966 . . . . 10.0 109.872 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.54 -42.03 83.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 115.352 -0.84 . . . . 10.0 111.985 174.954 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.437 ' HA ' ' HA2' ' A' ' 56' ' ' GLY . 0.1 OUTLIER -81.82 -25.54 35.08 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.446 0.641 . . . . 10.0 111.71 -177.776 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 54.9 m -73.55 -32.98 64.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.944 0.897 . . . . 10.0 112.312 174.03 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 89.54 124.19 2.51 Favored Glycine 0 C--N 1.343 0.923 0 CA-C-N 119.755 1.161 . . . . 10.0 111.634 -174.194 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.43 -157.54 0.79 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.139 0.976 . . . . 10.0 111.91 176.155 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -68.03 138.48 55.88 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-O 122.524 1.154 . . . . 10.0 109.508 -179.311 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.449 ' HB3' HMD2 ' A' ' 90' ' ' HEC . . . 56.29 18.86 3.58 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 111.516 -2.584 . . . . 10.0 112.003 176.459 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.0 ttp -136.89 121.64 12.64 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 123.993 0.917 . . . . 10.0 111.265 -171.733 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -68.36 143.89 59.84 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 121.602 1.535 . . . . 10.0 111.632 -174.971 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -62.16 113.95 2.11 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.43 2.753 . . . . 10.0 109.618 178.685 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.437 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 104.84 20.62 9.76 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 123.488 0.493 . . . . 10.0 112.75 -175.502 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 51.39 34.45 33.97 Favored Glycine 0 CA--C 1.54 1.605 0 CA-C-N 119.286 1.543 . . . . 10.0 114.116 177.434 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.0 ttt 65.16 23.12 12.31 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.15 1.78 . . . . 10.0 113.222 -176.554 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.3 t -121.91 155.61 35.1 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.725 1.21 . . . . 10.0 112.06 -170.732 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 80.2 m -88.49 -66.38 0.92 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.646 0.779 . . . . 10.0 111.139 179.736 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -124.46 63.78 1.1 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.403 1.081 . . . . 10.0 109.416 -177.747 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.0 m -81.54 118.89 23.12 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 121.686 -0.634 . . . . 10.0 110.45 172.01 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 62.2 m -108.28 135.44 49.6 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 108.345 -0.983 . . . . 10.0 108.345 179.707 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -32.38 -46.09 0.12 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.722 2.009 . . . . 10.0 114.477 -179.719 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -28.35 -60.85 0.12 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.682 1.993 . . . . 10.0 113.324 167.779 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.18 -37.14 12.26 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.937 0.895 . . . . 10.0 111.988 173.127 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.67 -39.07 50.03 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.985 -1.072 . . . . 10.0 112.311 -177.373 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.7 ptmt -75.51 -50.62 15.14 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.746 1.219 . . . . 10.0 109.361 178.671 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.87 -30.81 15.5 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.575 0.75 . . . . 10.0 111.955 179.174 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.481 ' N ' ' HB1' ' A' ' 3' ' ' ALA . . . -63.05 -44.85 94.69 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.546 0.738 . . . . 10.0 111.663 175.257 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 19.0 mt -73.18 -41.22 58.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 126.681 1.992 . . . . 10.0 111.086 177.425 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -63.83 -33.79 76.47 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.583 1.153 . . . . 10.0 111.862 174.836 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -55.13 -34.36 63.66 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 112.496 0.554 . . . . 10.0 112.496 171.282 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 65.6 mtm -86.43 -72.48 0.5 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.709 0.804 . . . . 10.0 112.229 -178.839 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -158.34 34.16 0.24 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.515 0.561 . . . . 10.0 112.515 178.064 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt 42.68 52.28 4.96 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.748 1.619 . . . . 10.0 113.86 172.237 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -158.94 -81.73 0.05 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.481 1.112 . . . . 10.0 112.656 173.233 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.456 ' HA ' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.229 0 N-CA-C 115.66 1.726 . . . . 10.0 115.66 -171.058 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.787 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.236 0 CA-C-O 119.552 -0.261 . . . . 10.0 111.524 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -166.35 128.52 1.86 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 119.228 -0.415 . . . . 10.0 111.412 -169.42 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . 0.254 0.0 OUTLIER -77.6 61.53 2.35 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 122.631 1.205 . . . . 10.0 111.183 178.554 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -109.91 -20.22 12.83 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.468 0.914 . . . . 10.0 113.468 -178.857 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -146.05 -175.79 4.9 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 105.437 -2.06 . . . . 10.0 105.437 177.04 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.545 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . . . -93.58 -44.32 8.26 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 126.215 1.806 . . . . 10.0 112.941 169.023 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -54.41 -37.74 65.42 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.528 0.68 . . . . 10.0 110.163 -177.451 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.94 -28.96 43.79 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.905 0.882 . . . . 10.0 113.087 174.802 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.28 -51.39 43.4 Favored 'Isoleucine or valine' 0 C--N 1.339 0.126 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 179.629 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -68.05 -29.46 68.44 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.363 -0.836 . . . . 10.0 111.035 -176.36 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.11 -23.29 65.82 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 126.072 1.749 . . . . 10.0 114.069 174.063 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 tppt? -100.66 -27.89 13.14 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.357 0.873 . . . . 10.0 113.357 172.174 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.99 -72.3 0.73 Allowed 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 124.988 1.315 . . . . 10.0 110.978 -167.068 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.74 37.3 0.14 Allowed 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.731 1.212 . . . . 10.0 110.667 179.043 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.0 t -120.53 -1.99 10.03 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.023 1.729 . . . . 10.0 114.041 -169.949 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 t -100.87 -39.89 7.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 122.362 1.077 . . . . 10.0 108.491 -174.275 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.0 m -101.09 -63.53 1.13 Allowed 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 128.003 2.521 . . . . 10.0 110.352 -177.709 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.4 m-70 -74.06 -29.15 61.75 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.483 1.29 . . . . 10.0 114.483 -168.693 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.1 m -54.8 -47.26 74.22 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.655 0.782 . . . . 10.0 110.881 178.59 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.4 ttt -116.26 -10.7 11.38 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.035 0.934 . . . . 10.0 112.526 -174.135 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.32 48.31 6.91 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 123.854 0.74 . . . . 10.0 112.85 -178.491 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 86.7 t -88.11 158.14 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 C-N-CA 125.438 1.495 . . . . 10.0 109.055 176.936 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.84 22.49 8.65 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.697 0.999 . . . . 10.0 113.697 -175.204 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.3 8.37 70.24 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 123.694 0.664 . . . . 10.0 113.332 -172.629 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.16 142.47 85.86 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 118.26 1.03 . . . . 10.0 111.713 -178.638 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' PRO . . . . . 0.448 ' HB2' ' HE2' ' A' ' 78' ' ' LYS . 83.4 Cg_endo -73.59 150.08 44.92 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.879 2.386 . . . . 10.0 111.092 -179.329 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.62 151.36 13.89 Favored 'General case' 0 C--O 1.245 0.851 0 CA-C-O 122.455 1.121 . . . . 10.0 112.482 -174.293 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.0 p -56.35 -34.35 66.53 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.104 2.562 . . . . 10.0 112.945 173.795 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -141.05 51.48 1.6 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.8 0.809 . . . . 10.0 112.41 177.275 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -69.64 161.62 29.31 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.133 -0.98 . . . . 10.0 109.948 170.592 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.4 t -107.86 -32.79 7.46 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.874 -0.516 . . . . 10.0 111.543 165.115 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.36 -24.78 39.57 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.42 -1.425 . . . . 10.0 113.587 -177.34 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.66 -18.98 39.12 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.745 1.618 . . . . 10.0 111.6 175.498 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -103.52 -34.19 8.76 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.744 1.618 . . . . 10.0 110.736 -176.853 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -43.29 -57.4 5.41 Favored Pre-proline 0 CA--C 1.545 0.786 0 CA-C-N 119.462 1.028 . . . . 10.0 113.637 170.991 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.12 3.53 3.94 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 122.187 1.925 . . . . 10.0 113.52 -179.308 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.568 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 8.0 mmt85 -104.74 -47.89 3.93 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.765 1.626 . . . . 10.0 108.728 178.374 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.489 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -57.0 0.16 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.38 2.272 . . . . 10.0 114.246 168.122 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.69 -22.28 24.74 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.808 1.243 . . . . 10.0 110.484 175.678 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.9 mtmm -106.16 -63.45 1.26 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.565 0.746 . . . . 10.0 111.056 174.37 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 156.95 -165.31 33.12 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 111.363 -0.695 . . . . 10.0 111.363 -176.254 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -100.87 -41.77 9.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 124.329 1.052 . . . . 10.0 111.739 178.671 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.49 10.42 0.06 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.819 2.048 . . . . 10.0 114.694 -177.028 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -105.9 -58.06 1.96 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 126.192 1.797 . . . . 10.0 107.099 178.331 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.5 mt -72.46 -30.67 64.78 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.022 -0.99 . . . . 10.0 109.847 -174.392 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 p -60.99 -33.23 54.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-O 121.745 0.783 . . . . 10.0 110.879 171.863 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -69.73 -41.74 74.9 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.236 -0.915 . . . . 10.0 110.609 177.696 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.1 m -63.15 -36.0 82.16 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.458 -0.776 . . . . 10.0 110.317 174.294 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.5 t -60.52 -51.05 77.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 121.145 0.497 . . . . 10.0 111.647 179.375 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -33.61 72.39 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.078 0.466 . . . . 10.0 112.256 176.657 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.1 m -73.38 -33.07 64.84 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.822 0.849 . . . . 10.0 112.048 179.535 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.28 114.82 0.16 Allowed Glycine 0 CA--C 1.528 0.89 0 N-CA-C 111.195 -0.762 . . . . 10.0 111.195 -169.479 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.28 -157.33 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.145 0.978 . . . . 10.0 110.563 167.873 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -72.24 -63.35 1.16 Allowed 'General case' 0 N--CA 1.476 0.848 0 O-C-N 119.367 -2.083 . . . . 10.0 111.388 -175.167 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.72 -19.43 60.24 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.961 1.305 . . . . 10.0 111.742 176.608 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.1 ttp -97.43 120.35 61.03 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 123.405 0.682 . . . . 10.0 111.757 -173.216 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -69.42 155.69 66.35 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 121.715 1.61 . . . . 10.0 111.941 -173.273 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -63.95 117.82 4.8 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.997 2.465 . . . . 10.0 109.515 -177.564 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.08 30.48 9.32 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 120.997 -0.62 . . . . 10.0 112.78 -175.201 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 66.74 -63.53 0.18 Allowed Glycine 0 CA--C 1.534 1.252 0 C-N-CA 126.499 1.999 . . . . 10.0 114.665 174.161 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.467 ' HB2' HMC2 ' A' ' 90' ' ' HEC . 5.8 ttp -171.84 -39.05 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.686 2.394 . . . . 10.0 110.685 171.82 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.51 -31.21 53.35 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 122.097 -0.377 . . . . 10.0 111.782 -178.604 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.8 m 72.76 -62.4 0.47 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.686 1.194 . . . . 10.0 112.592 -178.19 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -79.3 54.28 1.66 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.944 0.898 . . . . 10.0 110.579 -179.215 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.84 121.51 45.25 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.256 1.023 . . . . 10.0 109.718 -175.072 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 m -80.94 149.27 29.45 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.031 0.932 . . . . 10.0 110.53 -174.317 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -49.14 -40.21 31.76 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 120.121 1.328 . . . . 10.0 112.563 179.493 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -55.78 -38.8 70.39 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 113.521 0.934 . . . . 10.0 113.521 173.54 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -84.66 -38.27 20.01 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.876 1.27 . . . . 10.0 111.382 177.245 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -63.38 -55.1 27.21 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.376 -1.452 . . . . 10.0 111.426 178.157 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -48.99 74.43 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 107.573 -1.269 . . . . 10.0 107.573 -175.487 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.545 ' HB3' ' HB2' ' A' ' 3' ' ' ALA . . . -54.2 -31.52 53.21 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.367 0.506 . . . . 10.0 112.367 177.0 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.59 -50.14 53.94 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 119.206 0.912 . . . . 10.0 110.765 177.043 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 8.9 mt -60.54 -41.9 89.5 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.516 1.126 . . . . 10.0 111.701 176.232 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -65.41 -43.69 89.79 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.597 1.959 . . . . 10.0 112.374 175.138 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -55.61 -35.91 66.37 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.705 0.631 . . . . 10.0 112.705 174.501 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 56.2 mtm -76.61 -78.97 0.11 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.015 0.746 . . . . 10.0 113.015 179.787 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.4 t -151.62 37.06 0.58 Allowed 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.353 -0.842 . . . . 10.0 111.113 174.986 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 39.74 58.02 2.13 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.45 1.5 . . . . 10.0 113.5 172.923 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.568 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -155.02 -75.82 0.11 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.022 -0.99 . . . . 10.0 113.435 177.783 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.52 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.245 0 C-N-CA 125.903 1.681 . . . . 10.0 112.978 -171.339 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 90' ' ' HEC . . . . . 0.893 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.529 0.151 0 N-CA-C 110.548 -0.167 . . . . 10.0 110.548 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -145.02 122.8 11.89 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.987 -0.745 . . . . 10.0 108.987 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -53.86 -39.14 65.41 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.12 0.968 . . . . 10.0 112.573 172.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -58.67 -47.42 84.53 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 110.277 -0.268 . . . . 10.0 110.277 171.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.34 -31.78 72.28 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.426 -0.796 . . . . 10.0 110.688 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.5 mm -66.32 -50.98 63.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-O 118.442 -0.789 . . . . 10.0 110.145 176.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.18 -43.13 78.85 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 117.891 -1.524 . . . . 10.0 111.233 178.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.96 -22.57 64.11 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.376 1.47 . . . . 10.0 112.593 -175.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt -91.35 -31.57 16.02 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.408 -0.807 . . . . 10.0 113.178 168.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.48 -65.93 1.11 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.453 1.024 . . . . 10.0 112.506 -169.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.88 40.18 0.14 Allowed 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.088 1.355 . . . . 10.0 111.176 177.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.8 t -123.37 3.45 9.11 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 125.252 1.421 . . . . 10.0 113.779 -165.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 40.8 t -105.98 -46.83 8.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 124.234 1.013 . . . . 10.0 108.597 -174.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.6 m -91.01 -63.98 1.19 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 126.595 1.958 . . . . 10.0 111.471 177.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -73.32 -22.93 60.22 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.493 1.117 . . . . 10.0 113.977 -165.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.67 -53.74 54.82 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.157 0.983 . . . . 10.0 110.543 179.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 37.5 mmt -102.1 -23.8 14.02 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.402 1.081 . . . . 10.0 112.135 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.15 49.12 2.92 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 124.25 0.929 . . . . 10.0 112.04 -175.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 79.3 t -93.77 161.39 2.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.29 1.436 . . . . 10.0 109.397 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.07 18.9 6.76 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.456 1.102 . . . . 10.0 113.436 -174.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.3 18.43 76.23 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 124.566 1.079 . . . . 10.0 113.209 -173.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.56 145.53 90.19 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 118.525 1.162 . . . . 10.0 113.725 -172.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.88 137.21 17.47 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 125.047 3.832 . . . . 10.0 110.02 -177.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.24 139.69 58.8 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 123.95 0.9 . . . . 10.0 112.567 -163.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.5 p -51.31 -32.53 25.51 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.508 1.123 . . . . 10.0 113.249 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -134.2 115.34 14.06 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.694 1.197 . . . . 10.0 109.369 171.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -154.58 166.18 34.14 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 125.521 1.528 . . . . 10.0 108.425 176.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 56.5 m -110.13 -36.01 5.95 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 117.776 0.262 . . . . 10.0 111.637 168.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.49 -21.41 35.52 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.305 -0.872 . . . . 10.0 113.268 -176.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -78.67 -30.56 46.25 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.769 2.028 . . . . 10.0 109.528 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -92.67 -35.42 13.51 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 126.546 1.939 . . . . 10.0 111.849 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -43.18 -56.84 5.95 Favored Pre-proline 0 CA--C 1.549 0.94 0 N-CA-C 115.087 1.514 . . . . 10.0 115.087 175.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -67.95 -7.51 19.92 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.739 2.293 . . . . 10.0 113.413 -179.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -93.42 -51.62 4.89 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.684 1.194 . . . . 10.0 109.061 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.473 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.5 OUTLIER -61.77 8.78 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.868 1.667 . . . . 10.0 115.257 169.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.34 -37.92 14.53 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.977 0.911 . . . . 10.0 109.443 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -93.05 -38.72 11.48 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.01 0.924 . . . . 10.0 111.313 176.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 157.29 -143.56 9.69 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 111.325 -0.71 . . . . 10.0 111.325 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.9 t -127.04 -60.45 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 C-N-CA 123.734 0.814 . . . . 10.0 110.608 -176.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -44.96 -33.55 2.06 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.369 1.868 . . . . 10.0 113.653 176.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -48.34 -24.3 1.18 Allowed 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.101 1.36 . . . . 10.0 113.687 173.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -94.74 -47.04 6.65 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 125.431 1.492 . . . . 10.0 111.387 177.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.553 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.3 OUTLIER -51.96 -34.73 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 CA-C-N 119.434 1.015 . . . . 10.0 111.943 172.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -67.62 -44.01 79.03 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.525 -1.36 . . . . 10.0 112.627 169.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.5 m -64.08 -43.0 96.77 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.153 -0.967 . . . . 10.0 110.306 -177.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.553 HG12 ' HA ' ' A' ' 43' ' ' VAL . 7.6 p -65.64 -48.84 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 124.268 1.027 . . . . 10.0 111.634 178.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.59 -31.93 72.83 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.471 0.653 . . . . 10.0 110.828 176.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.3 m -74.04 -33.91 63.9 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.464 -0.772 . . . . 10.0 112.445 176.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 89.01 113.89 1.31 Allowed Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.587 -1.005 . . . . 10.0 110.587 -169.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.29 -170.03 0.9 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.985 0.514 . . . . 10.0 109.873 165.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.407 ' H ' ' ND2' ' A' ' 51' ' ' ASN . 19.6 m-80 -66.58 -57.02 8.11 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 119.904 -1.747 . . . . 10.0 111.745 -172.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.68 1.69 28.99 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 113.76 -1.564 . . . . 10.0 112.397 176.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 43.4 mtp -109.67 140.73 22.46 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 112.788 0.662 . . . . 10.0 112.788 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.9 149.19 65.68 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.65 1.567 . . . . 10.0 110.679 174.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -65.58 104.91 0.7 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.38 2.72 . . . . 10.0 110.155 -179.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 110.7 22.44 6.35 Favored Glycine 0 CA--C 1.525 0.7 0 CA-C-O 118.813 -0.993 . . . . 10.0 113.093 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 50.77 33.28 27.14 Favored Glycine 0 CA--C 1.535 1.286 0 CA-C-N 119.222 1.511 . . . . 10.0 114.477 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 6.0 ttm 60.2 29.87 19.37 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.866 1.667 . . . . 10.0 112.764 -176.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.6 -177.91 3.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.576 1.95 . . . . 10.0 110.171 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.5 t -145.99 -67.62 0.29 Allowed 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.582 -0.699 . . . . 10.0 110.72 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -105.41 31.22 5.08 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.671 1.188 . . . . 10.0 110.899 -176.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 64.8 m -88.92 114.07 25.15 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.768 1.227 . . . . 10.0 111.017 -172.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.4 p -86.3 151.18 23.8 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.433 0.693 . . . . 10.0 110.359 -174.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.79 -35.48 10.12 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 114.059 1.133 . . . . 10.0 114.059 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -49.28 -55.76 11.67 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.537 0.608 . . . . 10.0 111.348 171.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -76.29 -37.01 58.08 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.543 -0.723 . . . . 10.0 110.928 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -52.95 63.14 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 122.043 0.925 . . . . 10.0 111.115 -179.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.4 mmmm -64.87 -46.42 81.88 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 124.961 1.305 . . . . 10.0 108.96 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.94 -34.85 60.82 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 174.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.32 -43.5 70.16 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.644 -1.285 . . . . 10.0 111.279 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.23 -44.71 96.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 123.713 0.805 . . . . 10.0 112.051 169.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -76.1 -28.07 57.4 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.763 -1.211 . . . . 10.0 111.681 -175.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -46.87 -50.0 19.35 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.818 0.818 . . . . 10.0 110.716 170.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 72.2 mtm -68.46 -47.78 66.23 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.394 -0.821 . . . . 10.0 111.513 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 t -163.92 -87.41 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.353 0.661 . . . . 10.0 111.298 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt 172.43 53.15 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.825 2.05 . . . . 10.0 110.433 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.473 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -160.55 -85.27 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 114.025 1.12 . . . . 10.0 114.025 176.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.612 1.565 . . . . 10.0 115.072 -173.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 . . . . . 0 N--CA 1.457 -0.097 0 N-CA-C 112.621 0.6 . . . . 10.0 112.621 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -148.91 116.66 6.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.667 0.746 . . . . 10.0 110.207 176.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.41 -33.06 19.44 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 113.139 0.792 . . . . 10.0 113.139 171.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -55.26 -50.61 69.03 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 118.29 0.496 . . . . 10.0 110.906 169.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.85 -34.21 75.08 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.296 0.638 . . . . 10.0 110.785 -177.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.2 mm -65.57 -51.84 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 118.47 -0.776 . . . . 10.0 109.381 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.403 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -68.35 -40.47 81.52 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 120.211 1.369 . . . . 10.0 111.249 -178.465 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -68.68 -22.25 64.38 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.461 1.504 . . . . 10.0 112.615 -178.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.49 -29.54 16.94 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.038 -1.039 . . . . 10.0 113.502 167.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -106.62 -66.34 1.02 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.742 1.217 . . . . 10.0 112.442 -168.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.403 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -78.67 41.1 0.4 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.962 1.705 . . . . 10.0 109.771 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.8 t -123.21 4.09 9.21 Favored 'General case' 0 N--CA 1.461 0.084 0 C-N-CA 124.485 1.114 . . . . 10.0 112.997 -166.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.7 t -107.0 -53.68 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 C-N-CA 125.097 1.359 . . . . 10.0 108.676 -173.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.6 m -81.43 -62.18 1.73 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.609 1.163 . . . . 10.0 111.629 174.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -73.59 -19.34 60.9 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.967 1.307 . . . . 10.0 114.097 -164.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 t -64.92 -46.5 81.4 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.731 0.812 . . . . 10.0 111.032 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.8 mmt -104.56 -27.28 11.97 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.277 1.431 . . . . 10.0 111.88 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.38 52.8 1.8 Allowed Glycine 0 CA--C 1.533 1.174 0 C-N-CA 124.845 1.212 . . . . 10.0 112.156 -176.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 40.9 t -96.11 161.33 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.75 1.22 . . . . 10.0 109.786 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.23 16.89 5.25 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.083 1.353 . . . . 10.0 113.755 -176.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 74.95 25.52 69.05 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 123.858 0.742 . . . . 10.0 112.843 -172.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.25 141.56 91.53 Favored Pre-proline 0 CA--C 1.537 0.468 0 CA-C-N 118.384 1.092 . . . . 10.0 112.846 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -68.66 145.24 62.97 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 124.08 3.186 . . . . 10.0 110.754 177.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.6 mtpt -73.75 143.39 46.11 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.116 0.413 . . . . 10.0 112.116 -168.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.9 p -57.37 -26.03 60.39 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.119 0.968 . . . . 10.0 113.222 175.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -132.91 105.73 7.28 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.139 0.976 . . . . 10.0 109.338 171.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -147.09 157.98 43.79 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 106.898 -1.519 . . . . 10.0 106.898 173.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.1 t -104.31 -36.09 7.73 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.03 0.377 . . . . 10.0 110.876 166.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.03 -19.19 52.09 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.313 -1.492 . . . . 10.0 113.97 -176.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -89.75 -23.0 21.9 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.654 1.582 . . . . 10.0 110.398 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.596 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 49.4 m95 -97.82 -32.51 11.67 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.834 1.254 . . . . 10.0 110.591 178.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -44.14 -58.17 5.25 Favored Pre-proline 0 CA--C 1.542 0.646 0 N-CA-C 114.615 1.339 . . . . 10.0 114.615 172.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.47 6.85 2.1 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.685 2.257 . . . . 10.0 113.612 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -110.8 -42.51 4.0 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.866 1.666 . . . . 10.0 108.777 178.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.18 2.18 1.26 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.465 1.906 . . . . 10.0 114.232 170.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.0 14.57 28.7 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.539 1.136 . . . . 10.0 110.61 177.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 24.9 mmtt -125.42 -61.96 1.24 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.104 1.362 . . . . 10.0 110.606 173.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.451 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 172.09 -125.44 1.18 Allowed Glycine 0 CA--C 1.53 0.994 0 N-CA-C 110.321 -1.111 . . . . 10.0 110.321 -177.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.81 -55.74 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.299 0 C-N-CA 123.992 0.917 . . . . 10.0 110.6 -179.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.13 26.62 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.303 1.441 . . . . 10.0 113.995 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.451 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -102.78 -49.21 3.87 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.318 1.847 . . . . 10.0 107.208 177.527 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.6 mp -80.18 -35.05 36.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.634 -172.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.534 ' HA ' HG12 ' A' ' 46' ' ' VAL . 2.1 p -59.06 -23.76 25.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 124.841 1.257 . . . . 10.0 112.362 171.113 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -78.88 -44.89 21.84 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.359 -0.838 . . . . 10.0 111.321 171.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.22 -42.05 99.21 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.47 -0.769 . . . . 10.0 110.285 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.534 HG12 ' HA ' ' A' ' 43' ' ' VAL . 9.0 p -64.33 -48.2 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 122.901 0.48 . . . . 10.0 110.845 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -33.96 76.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.981 0.42 . . . . 10.0 110.325 177.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.0 m -73.41 -28.94 62.27 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.867 0.691 . . . . 10.0 112.867 175.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.79 119.43 1.42 Allowed Glycine 0 CA--C 1.529 0.918 0 CA-C-N 119.271 0.941 . . . . 10.0 111.126 -172.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.8 tp -78.49 -146.09 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 123.918 0.887 . . . . 10.0 110.241 171.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -82.11 -64.06 1.26 Allowed 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.003 -1.686 . . . . 10.0 111.048 -175.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.84 -7.86 56.26 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.677 1.191 . . . . 10.0 112.521 174.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.5 mtp -97.05 135.34 22.02 Favored Pre-proline 0 CA--C 1.538 0.501 0 N-CA-C 113.073 0.768 . . . . 10.0 113.073 178.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.03 157.09 55.16 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.189 1.926 . . . . 10.0 110.635 175.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.54 101.83 0.46 Allowed 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.233 2.622 . . . . 10.0 109.989 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 118.7 -0.15 15.51 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 123.681 0.658 . . . . 10.0 112.909 -172.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 75.71 -48.51 2.29 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 118.78 1.29 . . . . 10.0 112.667 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -174.44 -37.21 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.995 2.118 . . . . 10.0 111.366 166.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -79.25 177.44 8.83 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.947 0.721 . . . . 10.0 112.947 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 t -128.1 -60.67 1.13 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.998 1.319 . . . . 10.0 111.215 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.35 54.01 1.92 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.586 1.154 . . . . 10.0 111.393 -177.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 18.8 m -110.03 125.72 53.22 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.452 1.501 . . . . 10.0 111.372 -177.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 30.2 m -112.89 137.13 51.72 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.86 1.264 . . . . 10.0 109.776 -177.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -35.31 -46.18 0.35 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.775 2.03 . . . . 10.0 114.055 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -28.92 -64.29 0.1 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.341 1.856 . . . . 10.0 112.733 165.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -90.17 -34.19 15.94 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.284 0.633 . . . . 10.0 111.724 177.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.58 -44.69 56.91 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 120.707 -1.246 . . . . 10.0 112.487 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.16 -48.17 53.37 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.639 0.776 . . . . 10.0 110.6 174.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.2 -30.6 7.19 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.473 0.545 . . . . 10.0 112.473 172.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.97 -34.36 57.58 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.539 1.136 . . . . 10.0 111.53 -178.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -75.0 -52.87 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.519 1.128 . . . . 10.0 110.115 175.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -64.87 -25.71 68.01 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.513 0.725 . . . . 10.0 112.665 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -40.45 -48.08 2.71 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 121.75 0.786 . . . . 10.0 112.085 169.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.8 mpp? -74.68 -49.34 21.66 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.489 -0.778 . . . . 10.0 112.539 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.452 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 5.5 t -152.72 -89.91 0.05 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.787 -0.625 . . . . 10.0 110.208 175.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 169.17 54.96 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.812 1.645 . . . . 10.0 110.001 -176.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -167.22 -87.72 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.328 1.051 . . . . 10.0 113.08 173.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.596 ' HE3' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.285 -0.864 . . . . 10.0 112.414 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 . . . . . 0 N--CA 1.46 0.058 0 N-CA-C 112.028 0.381 . . . . 10.0 112.028 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -139.66 120.36 14.29 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 121.533 0.683 . . . . 10.0 109.463 171.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.24 -36.32 30.6 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.723 0.809 . . . . 10.0 113.089 171.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -59.64 -45.67 91.31 Favored 'General case' 0 C--N 1.343 0.309 0 O-C-N 121.972 -0.455 . . . . 10.0 110.622 171.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.05 -31.97 72.0 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.53 -0.731 . . . . 10.0 111.05 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.2 mm -65.32 -51.78 60.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 O-C-N 121.397 -0.814 . . . . 10.0 108.904 175.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.459 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.15 -42.28 76.18 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 117.87 -1.532 . . . . 10.0 111.905 -178.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.83 -22.0 64.26 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.466 1.506 . . . . 10.0 112.443 -177.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -92.04 -29.1 16.76 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.829 1.048 . . . . 10.0 113.829 168.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.91 -64.93 1.22 Allowed 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.218 1.007 . . . . 10.0 112.394 -170.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.459 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.56 40.63 0.18 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.222 1.409 . . . . 10.0 111.232 178.429 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.4 t -126.9 -4.09 6.4 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 124.805 1.242 . . . . 10.0 114.101 -165.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.4 t -97.29 -40.58 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-O 122.456 1.122 . . . . 10.0 108.426 -175.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.3 m -104.06 -61.09 1.48 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 126.765 2.026 . . . . 10.0 109.631 -173.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -74.27 -16.7 60.94 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.537 1.31 . . . . 10.0 114.537 -169.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.0 m -69.81 -44.91 69.05 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.692 0.797 . . . . 10.0 110.893 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 tpt -115.05 -30.66 6.29 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.318 1.047 . . . . 10.0 113.039 -175.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.38 61.4 1.81 Allowed Glycine 0 CA--C 1.535 1.342 0 C-N-CA 125.533 1.539 . . . . 10.0 113.183 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 67.2 t -81.8 -57.13 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.951 -0.735 . . . . 10.0 112.056 -175.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.75 35.4 0.51 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.066 0.947 . . . . 10.0 110.725 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 58.64 27.35 61.24 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 124.686 1.136 . . . . 10.0 113.094 -173.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.52 138.19 96.77 Favored Pre-proline 0 CA--C 1.547 0.863 0 O-C-N 122.042 -0.681 . . . . 10.0 111.943 -177.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -68.67 149.7 73.81 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 123.35 2.7 . . . . 10.0 111.025 -174.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -70.29 137.6 50.84 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.212 -0.93 . . . . 10.0 112.374 -161.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.4 m -51.53 -25.48 6.74 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.263 1.209 . . . . 10.0 114.263 172.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 -142.5 91.14 2.29 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.637 0.775 . . . . 10.0 110.632 174.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -128.07 171.15 12.14 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.64 1.176 . . . . 10.0 109.166 170.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.6 m -105.36 -33.28 8.23 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 119.37 -0.348 . . . . 10.0 110.925 163.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.91 -38.66 61.77 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.904 -1.122 . . . . 10.0 113.852 -176.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -66.79 -31.02 71.38 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.744 0.783 . . . . 10.0 110.072 177.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.458 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 64.4 m95 -91.79 -34.42 14.59 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.33 2.252 . . . . 10.0 111.982 -171.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -41.16 -61.98 1.17 Allowed Pre-proline 0 CA--C 1.546 0.816 0 N-CA-C 114.094 1.146 . . . . 10.0 114.094 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -71.26 8.79 1.02 Allowed 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 123.08 2.52 . . . . 10.0 114.006 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -113.36 -51.45 2.81 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.019 1.728 . . . . 10.0 108.448 -178.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -21.8 66.65 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.601 1.96 . . . . 10.0 112.053 173.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -79.64 -27.96 40.9 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.153 0.981 . . . . 10.0 110.057 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -76.41 -54.45 6.72 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.226 0.61 . . . . 10.0 109.936 174.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.48 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 162.5 -113.61 0.57 Allowed Glycine 0 CA--C 1.53 0.997 0 N-CA-C 111.167 -0.773 . . . . 10.0 111.167 176.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -144.09 -57.97 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.31 0 C-N-CA 124.201 1.0 . . . . 10.0 110.572 176.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.89 6.73 0.15 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.007 1.723 . . . . 10.0 113.537 -174.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.48 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -93.34 -17.87 23.07 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 125.467 1.507 . . . . 10.0 110.702 -178.459 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -106.4 -40.78 5.49 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.907 0.883 . . . . 10.0 110.949 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.9 p -52.16 -35.0 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 CA-C-O 121.087 0.47 . . . . 10.0 110.532 170.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.6 ptmt -62.28 -46.36 89.14 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.815 1.043 . . . . 10.0 113.815 171.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 64.0 m -67.09 -32.56 73.79 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 120.886 -1.134 . . . . 10.0 110.287 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.3 t -58.15 -58.02 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 122.839 0.456 . . . . 10.0 111.004 172.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -31.47 63.79 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.73 0.641 . . . . 10.0 112.73 175.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.71 -32.07 67.39 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 122.848 0.459 . . . . 10.0 112.097 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 79.13 94.4 0.31 Allowed Glycine 0 CA--C 1.532 1.117 0 N-CA-C 111.473 -0.651 . . . . 10.0 111.473 -174.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.5 tp -63.17 168.85 3.89 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.854 -0.792 . . . . 10.0 111.355 175.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.519 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 6.6 m-80 -48.56 -57.64 5.88 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.953 -1.092 . . . . 10.0 113.043 -171.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.15 21.48 8.82 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.421 1.488 . . . . 10.0 112.473 174.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 39.3 ttp -126.71 129.64 24.02 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 114.313 1.227 . . . . 10.0 114.313 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -63.15 158.03 46.31 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.481 2.121 . . . . 10.0 112.155 177.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -58.96 135.71 68.5 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.703 2.269 . . . . 10.0 110.263 -179.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.38 16.11 64.54 Favored Glycine 0 CA--C 1.527 0.841 0 O-C-N 121.742 -0.599 . . . . 10.0 113.872 -174.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 55.63 34.59 60.65 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 118.523 1.162 . . . . 10.0 112.285 -176.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 77.58 44.97 0.08 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.367 1.867 . . . . 10.0 112.529 -176.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.2 t -100.46 152.03 20.85 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.095 1.358 . . . . 10.0 110.901 171.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.5 p -108.78 -88.14 0.49 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.315 1.046 . . . . 10.0 110.132 164.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -106.14 74.93 1.07 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 126.53 1.932 . . . . 10.0 108.1 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -124.61 139.59 53.73 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.464 1.106 . . . . 10.0 110.514 174.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 93.6 m -111.43 153.16 26.51 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.845 1.258 . . . . 10.0 110.148 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -34.45 -45.02 0.21 Allowed 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 127.332 2.253 . . . . 10.0 114.54 176.272 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -41.19 -56.88 2.25 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 119.317 0.962 . . . . 10.0 113.518 170.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.12 -42.73 22.98 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.005 1.322 . . . . 10.0 112.739 175.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -55.25 -47.56 75.26 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.073 -1.017 . . . . 10.0 112.05 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 ptmm? -68.58 -52.21 34.24 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 108.442 -0.948 . . . . 10.0 108.442 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.75 -34.55 39.88 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.119 0.567 . . . . 10.0 112.36 177.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -64.2 -50.14 69.26 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.827 0.851 . . . . 10.0 109.811 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 8.9 mt -62.24 -44.15 98.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.181 0.993 . . . . 10.0 111.921 172.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -57.1 -37.92 72.62 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.303 1.441 . . . . 10.0 111.91 175.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -49.47 -43.41 45.04 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.476 0.547 . . . . 10.0 112.476 177.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.458 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -73.29 -69.83 0.4 Allowed 'General case' 0 CA--C 1.537 0.479 0 O-C-N 122.163 -0.336 . . . . 10.0 111.078 179.702 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.1 t -167.27 46.67 0.06 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.625 0.77 . . . . 10.0 111.807 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 37.88 60.71 1.15 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.471 1.508 . . . . 10.0 114.125 175.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -162.31 -82.0 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 113.232 0.827 . . . . 10.0 113.232 177.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.13 0 N-CA-C 114.74 1.385 . . . . 10.0 114.74 -173.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.531 0.248 0 N-CA-C 113.514 0.931 . . . . 10.0 113.514 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -151.49 115.16 4.88 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.526 0.731 . . . . 10.0 109.415 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -38.42 -43.77 0.86 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.943 1.697 . . . . 10.0 113.749 167.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -60.84 -48.08 83.43 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 117.983 0.356 . . . . 10.0 111.1 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.61 -30.89 71.28 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.509 -0.744 . . . . 10.0 110.461 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -65.63 -52.72 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-O 118.916 -0.564 . . . . 10.0 109.534 176.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.15 -40.48 78.17 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 118.161 -1.416 . . . . 10.0 110.858 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -68.66 -21.93 64.42 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.85 1.66 . . . . 10.0 112.738 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.82 -27.25 14.01 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 113.447 0.906 . . . . 10.0 113.447 168.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -103.46 -67.73 0.87 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.198 0.999 . . . . 10.0 112.409 -174.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.54 38.73 0.19 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.276 1.43 . . . . 10.0 111.001 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -120.39 -4.67 9.89 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 124.669 1.188 . . . . 10.0 113.782 -166.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.3 t -100.09 -40.95 8.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.346 1.058 . . . . 10.0 109.167 -169.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 m -99.46 -61.26 1.39 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.292 2.237 . . . . 10.0 110.903 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -73.44 -22.78 60.11 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.181 0.993 . . . . 10.0 113.542 -167.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.4 t -61.63 -52.48 64.17 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.573 0.749 . . . . 10.0 110.989 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -101.42 -22.38 14.57 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.328 1.051 . . . . 10.0 111.775 -179.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.04 52.78 2.67 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.702 1.144 . . . . 10.0 111.956 -175.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 59.7 t -96.68 160.18 2.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 125.262 1.425 . . . . 10.0 109.494 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 60.68 18.6 8.66 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.197 0.999 . . . . 10.0 113.486 -176.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 82.12 3.89 90.42 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 124.082 0.849 . . . . 10.0 113.444 -173.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.49 146.28 64.86 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-N 118.164 0.982 . . . . 10.0 113.394 -174.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -70.5 155.33 63.71 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 123.73 2.954 . . . . 10.0 109.723 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -68.95 139.68 55.06 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 119.825 -0.75 . . . . 10.0 111.573 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -32.24 -45.34 0.11 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.848 2.059 . . . . 10.0 113.45 169.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -139.28 102.14 4.42 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.004 0.922 . . . . 10.0 109.191 170.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -118.03 157.92 25.93 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.059 -1.46 . . . . 10.0 107.059 170.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 92.9 m -103.79 -35.49 8.18 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.519 0.6 . . . . 10.0 111.279 171.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.82 -23.64 36.35 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.102 -0.999 . . . . 10.0 113.269 -178.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.435 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 33.0 t0 -87.62 -22.3 24.82 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.072 1.749 . . . . 10.0 110.517 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.448 ' CZ3' ' HB2' ' A' ' 74' ' ' MET . 36.7 m95 -95.39 -35.59 11.68 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.06 1.744 . . . . 10.0 110.803 177.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -40.14 -59.54 1.8 Allowed Pre-proline 0 N--CA 1.476 0.825 0 N-CA-C 114.248 1.203 . . . . 10.0 114.248 170.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.05 17.51 0.33 Allowed 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 123.379 2.719 . . . . 10.0 113.925 -179.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.83 -43.49 2.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.426 1.89 . . . . 10.0 110.336 168.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.1 -13.02 5.73 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.536 1.934 . . . . 10.0 112.488 174.052 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.62 24.18 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.586 1.155 . . . . 10.0 110.513 176.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -77.01 -52.21 9.74 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.144 -0.688 . . . . 10.0 109.144 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.474 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 157.66 -116.61 0.73 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.545 1.069 . . . . 10.0 110.594 175.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . 0.405 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -149.02 -55.82 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.314 1.046 . . . . 10.0 110.331 174.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.442 ' HA ' HG12 ' A' ' 43' ' ' VAL . 0.8 OUTLIER -71.76 28.88 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.265 1.026 . . . . 10.0 113.515 -177.113 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.474 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -101.53 -56.3 2.33 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 128.053 2.541 . . . . 10.0 107.217 176.607 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.65 -26.41 32.18 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.71 -0.662 . . . . 10.0 111.161 -172.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.461 HG23 HD13 ' A' ' 71' ' ' ILE . 1.2 p -57.17 -22.6 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 125.578 1.551 . . . . 10.0 111.767 166.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.9 mmpt? -80.62 -38.27 29.56 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.227 0.611 . . . . 10.0 111.728 169.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.84 -37.7 64.75 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 120.471 -1.393 . . . . 10.0 110.874 -176.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.442 HG12 ' HA ' ' A' ' 43' ' ' VAL . 10.7 p -61.79 -42.46 94.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.246 1.018 . . . . 10.0 110.544 173.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -35.81 76.71 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.143 0.497 . . . . 10.0 109.683 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 28.0 m -73.05 -34.34 66.22 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.153 -0.967 . . . . 10.0 111.88 177.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.54 115.65 3.72 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.457 -1.057 . . . . 10.0 110.457 -168.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.02 -152.9 0.06 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 167.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -81.51 -60.69 2.17 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.652 -1.28 . . . . 10.0 110.428 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.09 -7.21 59.2 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.448 1.499 . . . . 10.0 112.335 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.72 142.59 25.3 Favored Pre-proline 0 N--CA 1.468 0.442 0 N-CA-C 112.236 0.458 . . . . 10.0 112.236 177.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.66 148.0 71.04 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.376 2.051 . . . . 10.0 110.753 175.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -66.67 110.22 1.83 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.216 2.611 . . . . 10.0 109.825 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 91.52 35.9 6.74 Favored Glycine 0 C--N 1.338 0.688 0 CA-C-O 119.617 -0.546 . . . . 10.0 111.872 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 28.94 39.38 0.02 OUTLIER Glycine 0 CA--C 1.535 1.33 0 C-N-CA 127.365 2.412 . . . . 10.0 115.661 -172.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 62.83 -0.85 0.52 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.844 2.057 . . . . 10.0 115.793 -174.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.6 p -94.02 -29.07 15.4 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.608 1.163 . . . . 10.0 112.541 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 96.7 m 65.54 -71.34 0.08 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.149 1.38 . . . . 10.0 111.97 -178.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -79.63 54.52 1.81 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.22 1.408 . . . . 10.0 109.962 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -94.0 117.28 29.89 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.637 1.175 . . . . 10.0 109.307 -174.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 90.9 m -116.34 129.1 56.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.029 -1.101 . . . . 10.0 108.029 -174.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -37.39 -41.45 0.43 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.93 1.692 . . . . 10.0 112.533 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -35.42 -57.36 0.61 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 114.245 1.202 . . . . 10.0 114.245 169.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -91.94 -34.98 14.26 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.188 0.904 . . . . 10.0 111.25 173.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.95 -42.2 85.66 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.5 -1.375 . . . . 10.0 112.559 -170.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -42.73 99.9 Favored 'General case' 0 C--O 1.222 -0.35 0 O-C-N 121.353 -0.842 . . . . 10.0 109.909 174.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.39 -28.8 69.52 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.351 1.06 . . . . 10.0 111.999 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.64 -46.38 38.58 Favored 'General case' 0 C--O 1.223 -0.341 0 O-C-N 121.007 -1.058 . . . . 10.0 109.604 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.461 HD13 HG23 ' A' ' 43' ' ' VAL . 0.9 OUTLIER -61.45 -46.65 96.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 121.514 0.673 . . . . 10.0 111.407 170.667 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . 0.256 0.0 OUTLIER -59.63 -35.38 74.26 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 121.491 -0.756 . . . . 10.0 112.185 -177.866 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -44.61 -41.14 6.36 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.34 0.867 . . . . 10.0 113.34 178.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.448 ' HB2' ' CZ3' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -76.72 -67.5 0.69 Allowed 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.113 -0.367 . . . . 10.0 111.713 -177.323 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.0 t -164.07 33.81 0.08 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.696 0.798 . . . . 10.0 112.479 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt 38.23 61.27 1.14 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.863 1.265 . . . . 10.0 114.172 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -149.49 -55.57 0.18 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.073 0.949 . . . . 10.0 112.806 -178.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.435 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.2 0 C-N-CA 125.97 1.708 . . . . 10.0 112.134 -171.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.348 0 N-CA-C 112.14 0.422 . . . . 10.0 112.14 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -139.87 121.53 15.3 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 124.697 1.199 . . . . 10.0 107.996 172.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -44.84 -41.0 6.68 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.114 1.366 . . . . 10.0 113.363 168.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -59.51 -47.27 86.15 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.053 -0.405 . . . . 10.0 110.901 171.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.17 -31.3 70.76 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.705 -0.622 . . . . 10.0 111.123 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.3 mt -64.44 -53.12 46.66 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 N-CA-C 107.981 -1.118 . . . . 10.0 107.981 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.43 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.3 OUTLIER -69.69 -41.58 75.24 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 117.836 -1.545 . . . . 10.0 112.085 -177.427 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.78 -21.8 64.32 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.299 1.839 . . . . 10.0 112.566 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.65 -28.56 15.29 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.291 0.848 . . . . 10.0 113.291 168.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -108.05 -64.67 1.19 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.173 0.989 . . . . 10.0 112.652 -170.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.1 41.74 0.3 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.911 1.285 . . . . 10.0 110.552 178.302 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.2 t -126.82 4.04 6.65 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.556 1.142 . . . . 10.0 113.507 -165.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.9 t -109.75 -53.76 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 C-N-CA 125.175 1.39 . . . . 10.0 108.676 -172.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.9 m -79.31 -64.31 1.22 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.856 1.262 . . . . 10.0 110.422 173.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -73.81 -10.39 59.62 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.152 1.781 . . . . 10.0 115.058 -165.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 t -72.01 -48.18 46.57 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.92 0.488 . . . . 10.0 109.968 178.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.3 tpt -106.59 -41.07 5.36 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.155 0.982 . . . . 10.0 112.439 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 96.25 62.47 0.96 Allowed Glycine 0 CA--C 1.536 1.376 0 C-N-CA 125.495 1.522 . . . . 10.0 112.666 -175.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 95.3 t -82.41 -55.99 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 O-C-N 121.854 -0.792 . . . . 10.0 112.027 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.94 32.92 0.43 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.064 0.946 . . . . 10.0 111.079 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 66.33 16.66 65.21 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 124.635 1.112 . . . . 10.0 113.442 -173.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.29 141.46 96.23 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 113.4 0.889 . . . . 10.0 113.4 -174.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.58 138.56 38.68 Favored 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 124.764 3.642 . . . . 10.0 110.717 -176.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.4 mttm -69.32 138.54 53.86 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 121.715 -0.616 . . . . 10.0 111.157 -168.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.6 t -47.46 -36.95 10.8 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.076 0.769 . . . . 10.0 113.076 175.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -119.8 73.72 0.98 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.646 1.578 . . . . 10.0 111.889 179.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -117.74 159.8 22.4 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.046 -1.034 . . . . 10.0 109.757 171.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 57.6 m -108.33 -35.9 6.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.5 0.32 . . . . 10.0 111.39 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.01 -23.32 31.01 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 121.699 -0.625 . . . . 10.0 112.363 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -80.19 -33.86 37.88 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.859 1.663 . . . . 10.0 109.769 178.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.529 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 58.4 m95 -86.41 -35.33 19.8 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.039 1.736 . . . . 10.0 111.772 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -39.61 -59.69 1.56 Allowed Pre-proline 0 CA--C 1.548 0.887 0 O-C-N 120.272 -1.518 . . . . 10.0 114.762 172.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -75.06 15.46 0.74 Allowed 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.617 2.878 . . . . 10.0 113.528 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.615 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -116.57 -45.45 2.8 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.531 1.932 . . . . 10.0 108.176 177.609 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.414 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 1.3 mt -58.18 0.35 0.07 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 127.623 2.369 . . . . 10.0 114.208 168.063 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -84.04 -29.12 27.14 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.218 1.407 . . . . 10.0 110.076 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -94.61 -64.68 1.05 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.865 0.866 . . . . 10.0 109.359 -179.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.486 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 129.51 119.97 2.2 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 124.184 0.897 . . . . 10.0 112.127 171.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.6 m -38.59 116.06 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 114.214 1.19 . . . . 10.0 114.214 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 138.23 -19.99 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 130.142 3.377 . . . . 10.0 110.819 -169.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.486 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -78.09 -57.51 3.75 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.436 1.017 . . . . 10.0 109.985 172.236 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.2 mp -76.7 -24.06 53.12 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.52 -0.737 . . . . 10.0 111.76 -168.306 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -60.15 -27.37 38.99 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 O-C-N 121.686 -0.634 . . . . 10.0 110.829 170.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.9 mmpt? -67.53 -45.84 74.56 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.347 -0.845 . . . . 10.0 110.761 171.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.9 m -62.08 -36.57 82.08 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.174 -0.953 . . . . 10.0 110.155 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.2 t -58.84 -54.13 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 121.065 0.46 . . . . 10.0 111.177 175.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -33.92 71.67 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.325 0.491 . . . . 10.0 112.325 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 58.7 m -71.56 -27.48 63.19 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.696 0.799 . . . . 10.0 112.852 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 76.67 91.93 0.23 Allowed Glycine 0 CA--C 1.53 0.985 0 CA-C-N 119.336 0.971 . . . . 10.0 112.27 -174.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.94 167.99 1.43 Allowed 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 122.056 0.932 . . . . 10.0 111.419 171.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.508 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 13.7 m-80 -53.66 -55.3 27.21 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.515 -1.365 . . . . 10.0 112.417 -172.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.15 19.93 2.94 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 113.862 -1.517 . . . . 10.0 112.573 174.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.0 ttp -136.15 134.94 20.49 Favored Pre-proline 0 CA--C 1.546 0.802 0 N-CA-C 114.769 1.396 . . . . 10.0 114.769 -175.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.14 147.66 73.48 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 120.965 1.11 . . . . 10.0 111.553 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -61.5 132.61 41.51 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.251 2.634 . . . . 10.0 109.853 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.65 15.05 81.88 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 119.711 -1.233 . . . . 10.0 112.76 -172.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.09 34.63 6.03 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 118.36 1.08 . . . . 10.0 113.728 -177.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 77.18 37.92 0.25 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 126.231 1.812 . . . . 10.0 113.583 -177.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 9.8 t -126.03 164.6 20.5 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.427 1.491 . . . . 10.0 111.65 169.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.0 m -102.88 -64.06 1.11 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.686 1.194 . . . . 10.0 111.62 -178.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -122.56 46.51 2.13 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.893 1.277 . . . . 10.0 110.536 -176.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 5.4 m -71.98 116.02 11.88 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 120.824 -1.173 . . . . 10.0 110.068 172.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 t -85.08 138.85 32.16 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.284 0.634 . . . . 10.0 109.612 172.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -36.73 -40.09 0.25 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.49 1.916 . . . . 10.0 112.46 174.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -42.17 -55.17 3.37 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.912 1.285 . . . . 10.0 114.049 170.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -89.45 -33.85 16.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.065 0.546 . . . . 10.0 111.278 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.67 -43.79 65.77 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.417 1.087 . . . . 10.0 111.417 176.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -72.45 -45.15 60.88 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.86 1.264 . . . . 10.0 110.159 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -57.68 -33.5 68.41 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.432 -0.793 . . . . 10.0 111.577 174.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.56 -46.66 84.88 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 124.039 0.935 . . . . 10.0 110.561 -176.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 25.0 pt -76.59 -37.99 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 124.061 0.945 . . . . 10.0 112.28 174.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -58.19 -36.74 73.52 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.893 -0.504 . . . . 10.0 112.345 173.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -51.08 -44.96 61.3 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 174.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -67.62 -75.01 0.1 Allowed 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.618 0.599 . . . . 10.0 112.618 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -153.75 25.51 0.5 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.11 0.564 . . . . 10.0 111.769 -179.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 34.39 61.35 0.55 Allowed 'General case' 0 C--N 1.339 0.143 0 C-N-CA 126.895 2.078 . . . . 10.0 115.696 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.615 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -142.84 -56.76 0.43 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.311 -0.858 . . . . 10.0 112.676 -176.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.529 ' HE3' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.954 0 CA-C-O 116.624 -1.655 . . . . 10.0 112.823 -177.83 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 . . . . . 0 CA--C 1.533 0.312 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -141.17 131.2 24.61 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.159 -1.052 . . . . 10.0 108.159 166.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -46.29 -40.52 11.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.877 1.271 . . . . 10.0 112.783 169.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -56.24 -50.53 71.05 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.684 0.394 . . . . 10.0 111.008 171.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.15 -32.25 72.4 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.906 -0.496 . . . . 10.0 110.788 -176.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mt -64.69 -52.66 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 108.566 -0.901 . . . . 10.0 108.566 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.479 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.07 -41.58 77.35 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 117.882 -1.527 . . . . 10.0 112.033 -178.419 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -68.91 -22.13 64.18 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.757 1.623 . . . . 10.0 112.608 -176.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.0 tttp -95.77 -28.13 14.91 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.976 0.91 . . . . 10.0 113.35 170.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.5 -65.03 1.18 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.287 1.035 . . . . 10.0 112.318 -171.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.479 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.82 41.43 0.21 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.16 1.384 . . . . 10.0 111.013 178.118 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -125.41 -2.38 7.46 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 114.173 1.175 . . . . 10.0 114.173 -164.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 46.9 t -99.46 -47.99 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 124.574 1.15 . . . . 10.0 108.48 -177.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 89.9 m -95.48 -59.43 1.88 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.696 1.998 . . . . 10.0 110.602 -173.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 -74.44 -17.98 60.7 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 -171.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.2 t -62.84 -49.91 73.01 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 122.99 0.516 . . . . 10.0 110.465 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.3 tpt -102.84 -33.78 9.23 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.633 0.773 . . . . 10.0 112.705 176.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 101.45 56.52 0.86 Allowed Glycine 0 CA--C 1.536 1.382 0 C-N-CA 125.078 1.323 . . . . 10.0 111.572 -170.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 82.4 t -98.97 157.74 3.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.631 1.572 . . . . 10.0 109.703 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.15 24.24 11.09 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.448 1.099 . . . . 10.0 112.894 -175.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.18 5.47 87.3 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.124 0.868 . . . . 10.0 113.497 -174.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.87 145.83 77.86 Favored Pre-proline 0 CA--C 1.538 0.484 0 CA-C-N 118.771 1.286 . . . . 10.0 112.545 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -66.11 163.18 32.49 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 C-N-CA 123.599 2.866 . . . . 10.0 109.192 171.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.0 tttp -84.31 149.24 26.2 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 121.624 0.726 . . . . 10.0 110.908 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.7 p -43.28 -70.02 0.12 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.173 1.789 . . . . 10.0 111.4 170.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -103.48 119.98 39.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.823 1.649 . . . . 10.0 108.133 174.085 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -151.76 167.74 27.28 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 126.24 1.816 . . . . 10.0 108.19 171.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.0 m -110.77 -36.21 5.77 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 170.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.36 -14.03 41.85 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.288 -0.883 . . . . 10.0 113.159 -177.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -87.25 -27.21 23.07 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.515 1.926 . . . . 10.0 110.191 176.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 83.9 m95 -95.66 -38.84 10.19 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.367 1.867 . . . . 10.0 112.017 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -41.7 -57.86 3.62 Favored Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 114.682 1.364 . . . . 10.0 114.682 173.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.12 1.16 4.24 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.331 2.687 . . . . 10.0 113.949 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -102.93 -43.66 5.46 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.12 1.368 . . . . 10.0 109.237 177.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.5 5.31 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.107 1.763 . . . . 10.0 114.757 165.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.14 -30.69 18.42 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.59 1.156 . . . . 10.0 110.32 176.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -91.34 -54.66 3.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.121 0.568 . . . . 10.0 111.218 174.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.479 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 161.34 -123.14 1.18 Allowed Glycine 0 CA--C 1.533 1.186 0 N-CA-C 111.782 -0.527 . . . . 10.0 111.782 178.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.4 -65.54 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.271 1.029 . . . . 10.0 111.75 -177.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.7 15.86 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.871 1.668 . . . . 10.0 115.304 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.479 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.3 OUTLIER -93.03 -48.74 6.36 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.401 1.48 . . . . 10.0 108.661 178.152 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.6 mt -81.03 -33.43 33.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 124.325 1.05 . . . . 10.0 110.13 -168.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.4 p -54.59 -32.43 25.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-O 121.651 0.738 . . . . 10.0 111.627 169.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -64.85 -41.71 95.49 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.645 -0.659 . . . . 10.0 110.892 177.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.0 m -67.69 -34.31 76.65 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.52 -0.738 . . . . 10.0 110.338 174.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.0 t -58.38 -52.51 58.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 O-C-N 121.791 -0.568 . . . . 10.0 111.173 175.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.6 -37.45 70.68 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.187 0.44 . . . . 10.0 112.187 174.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -71.87 -33.66 68.57 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.218 0.607 . . . . 10.0 111.972 -177.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.9 97.54 0.25 Allowed Glycine 0 CA--C 1.535 1.285 0 N-CA-C 111.482 -0.647 . . . . 10.0 111.482 -169.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.8 tt -61.54 167.3 3.51 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.845 -0.797 . . . . 10.0 111.197 173.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.513 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 5.1 m-80 -45.51 -58.89 3.04 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.553 -1.342 . . . . 10.0 113.545 -172.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -93.98 19.36 9.16 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.312 1.445 . . . . 10.0 112.859 175.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 34.9 ttp -125.23 129.09 24.6 Favored Pre-proline 0 CA--C 1.553 1.084 0 N-CA-C 114.116 1.154 . . . . 10.0 114.116 173.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -63.06 158.29 44.52 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.229 1.953 . . . . 10.0 111.864 176.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -60.3 148.16 91.13 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.792 2.328 . . . . 10.0 111.021 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 53.12 31.57 41.21 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-N 115.916 -0.583 . . . . 10.0 113.598 -174.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 42.42 32.45 1.21 Allowed Glycine 0 CA--C 1.543 1.813 0 C-N-CA 124.554 1.073 . . . . 10.0 114.534 -170.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.3 ttm 81.24 27.09 0.2 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.068 2.147 . . . . 10.0 114.896 -176.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.7 t -104.76 165.63 10.94 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 120.857 -1.152 . . . . 10.0 112.172 171.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 29.4 m -100.71 -91.94 0.3 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.788 1.235 . . . . 10.0 109.682 174.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -92.57 46.53 1.25 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.441 1.096 . . . . 10.0 110.7 -173.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.61 115.89 16.78 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.692 -1.255 . . . . 10.0 109.943 175.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 93.7 m -80.16 149.82 30.39 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.514 0.725 . . . . 10.0 109.596 174.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -32.77 -55.74 0.37 Allowed 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.123 1.157 . . . . 10.0 114.123 167.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -48.22 -55.47 10.4 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.501 0.72 . . . . 10.0 111.675 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -73.57 -35.68 65.49 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.854 -0.529 . . . . 10.0 111.473 -177.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -56.94 -50.69 71.83 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.751 0.786 . . . . 10.0 110.987 172.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -64.58 -50.59 66.64 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.434 1.494 . . . . 10.0 109.544 -177.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.64 -39.67 25.02 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.033 0.533 . . . . 10.0 112.022 169.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.09 -47.71 60.75 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 120.862 -1.149 . . . . 10.0 112.186 177.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mt -55.94 -48.99 77.8 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 C-N-CA 124.85 1.26 . . . . 10.0 111.431 174.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -24.97 58.29 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.94 -1.1 . . . . 10.0 113.195 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -47.03 -50.63 19.12 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 119.152 0.887 . . . . 10.0 111.295 170.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -70.61 -44.33 67.48 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 178.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -154.2 -77.32 0.11 Allowed 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.928 -0.558 . . . . 10.0 112.35 172.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 157.99 58.22 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 128.697 2.799 . . . . 10.0 111.215 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -174.14 -75.96 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.809 1.411 . . . . 10.0 114.809 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.9 pttp . . . . . 0 C--O 1.256 1.415 0 N-CA-C 115.603 1.705 . . . . 10.0 115.603 -174.412 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.294 0 N-CA-C 112.93 0.715 . . . . 10.0 112.93 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -142.05 124.29 15.54 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 107.302 -1.37 . . . . 10.0 107.302 171.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.407 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . . . -50.98 -37.26 43.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 172.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -55.75 -49.57 72.74 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.648 0.658 . . . . 10.0 109.864 172.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.64 -33.71 74.48 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.866 0.466 . . . . 10.0 111.106 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.91 -51.31 62.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 107.929 -1.137 . . . . 10.0 107.929 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.411 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -68.93 -42.1 77.22 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 119.615 1.098 . . . . 10.0 111.187 -178.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -68.26 -22.23 64.77 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.906 1.282 . . . . 10.0 112.639 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.9 tppt? -93.68 -28.17 16.13 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.485 1.114 . . . . 10.0 113.647 169.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -108.71 -68.87 0.89 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.387 1.475 . . . . 10.0 112.777 -171.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.411 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.54 45.05 0.38 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.393 1.477 . . . . 10.0 109.683 179.079 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.9 t -128.7 -5.5 5.18 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 125.388 1.475 . . . . 10.0 113.343 -167.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.1 t -101.91 -34.19 3.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 125.269 1.427 . . . . 10.0 109.171 -173.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.2 m -102.57 -63.31 1.17 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.101 2.16 . . . . 10.0 110.947 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -73.41 -24.9 60.33 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 114.062 1.134 . . . . 10.0 114.062 -162.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -58.59 -50.79 72.52 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.281 1.032 . . . . 10.0 111.339 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.6 tpt -105.07 -17.9 14.34 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.661 0.784 . . . . 10.0 112.073 -178.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.01 50.17 4.0 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 124.191 0.901 . . . . 10.0 112.17 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 47.0 t -95.51 162.17 2.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 125.344 1.458 . . . . 10.0 109.616 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.84 19.29 8.18 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.632 1.173 . . . . 10.0 113.042 -174.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.9 18.17 79.08 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 124.042 0.829 . . . . 10.0 113.003 -173.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.76 148.57 92.54 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 118.52 1.16 . . . . 10.0 112.649 -178.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.4 ' CG ' ' HE3' ' A' ' 78' ' ' LYS . 87.0 Cg_endo -76.14 153.3 36.37 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 124.958 3.772 . . . . 10.0 110.272 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -67.69 144.48 55.45 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.83 -172.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.3 m -34.26 -43.11 0.15 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.898 1.679 . . . . 10.0 113.679 169.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -143.61 110.31 5.56 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.661 0.743 . . . . 10.0 109.765 173.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -129.05 162.93 26.53 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 106.44 -1.689 . . . . 10.0 106.44 174.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 90.2 m -106.17 -36.2 6.97 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.756 0.707 . . . . 10.0 111.157 169.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.06 -26.57 59.49 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 120.63 -1.294 . . . . 10.0 112.735 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -90.07 -8.46 51.39 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.864 1.666 . . . . 10.0 110.645 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.441 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 48.5 m95 -110.73 -29.91 7.8 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.699 -1.25 . . . . 10.0 109.884 176.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -39.49 -60.58 1.24 Allowed Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 125.496 1.518 . . . . 10.0 114.292 170.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -67.99 2.4 2.65 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.295 1.997 . . . . 10.0 113.898 -177.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -113.51 -47.33 3.0 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.246 1.419 . . . . 10.0 110.48 176.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.548 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -63.34 -18.7 63.92 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.731 1.613 . . . . 10.0 112.911 173.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.12 -31.38 61.1 Favored 'General case' 0 N--CA 1.457 -0.104 0 C-N-CA 124.648 1.179 . . . . 10.0 109.588 178.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.1 mmtt -77.79 -56.14 4.75 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.313 171.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.09 -114.25 0.65 Allowed Glycine 0 CA--C 1.531 1.039 0 N-CA-C 111.987 -0.445 . . . . 10.0 111.987 173.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.86 168.16 19.64 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.076 0 C-N-CA 125.567 1.547 . . . . 10.0 109.796 175.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.412 ' HA ' HG12 ' A' ' 43' ' ' VAL . 0.7 OUTLIER 76.18 -34.04 0.23 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.331 1.452 . . . . 10.0 112.212 -174.204 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.3 -24.4 54.75 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 120.241 -1.537 . . . . 10.0 114.124 -177.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -105.92 -33.9 7.79 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.461 1.104 . . . . 10.0 111.939 -178.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.412 HG12 ' HA ' ' A' ' 40' ' ' ASP . 0.5 OUTLIER -56.53 -35.11 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 121.299 -0.876 . . . . 10.0 109.751 170.402 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.13 -42.72 91.29 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.972 1.101 . . . . 10.0 113.972 168.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.9 m -65.9 -39.5 90.66 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 120.688 -1.258 . . . . 10.0 110.442 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 15.6 t -56.31 -51.75 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.49 0.716 . . . . 10.0 110.811 176.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -62.95 -33.83 76.2 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.961 0.726 . . . . 10.0 112.961 176.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 85.3 m -72.31 -24.32 61.3 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.211 0.605 . . . . 10.0 112.314 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.28 92.56 0.3 Allowed Glycine 0 CA--C 1.533 1.218 0 CA-C-N 119.298 0.954 . . . . 10.0 112.371 -178.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -179.09 1.02 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.215 1.007 . . . . 10.0 111.951 175.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -55.97 -54.84 39.98 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 123.557 1.646 . . . . 10.0 111.243 -163.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.93 20.77 10.59 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 128.002 2.521 . . . . 10.0 111.927 176.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -130.75 128.39 22.44 Favored Pre-proline 0 CA--C 1.545 0.76 0 N-CA-C 113.341 0.867 . . . . 10.0 113.341 -177.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -70.02 157.76 58.81 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 121.497 1.465 . . . . 10.0 111.13 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -63.83 114.11 2.45 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 123.415 2.743 . . . . 10.0 109.846 -177.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 92.61 11.94 58.76 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-O 119.853 -0.415 . . . . 10.0 114.097 -171.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.39 -44.06 2.39 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-N 118.692 1.246 . . . . 10.0 113.486 173.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.26 -47.31 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.793 1.637 . . . . 10.0 111.893 172.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.68 159.11 26.82 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.211 1.404 . . . . 10.0 111.673 178.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 86.2 m -103.6 -64.17 1.12 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.744 1.218 . . . . 10.0 112.041 175.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -80.92 56.62 2.8 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.967 0.907 . . . . 10.0 110.784 -173.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.405 ' HB2' ' CE2' ' A' ' 67' ' ' TYR . 0.0 OUTLIER -101.12 139.72 36.41 Favored 'General case' 0 CA--C 1.527 0.063 0 C-N-CA 124.642 1.177 . . . . 10.0 110.802 -173.73 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.0 m -110.77 143.93 40.53 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.12 0.968 . . . . 10.0 108.971 -176.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -47.09 -36.89 8.79 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 114.056 1.132 . . . . 10.0 114.056 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -51.33 -52.62 43.82 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.229 0.922 . . . . 10.0 111.78 170.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.76 -46.32 54.02 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.957 0.799 . . . . 10.0 110.635 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.405 ' CE2' ' HB2' ' A' ' 62' ' ' CYS . 1.6 m-85 -58.99 -51.66 69.11 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 120.838 -1.164 . . . . 10.0 111.424 -179.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -68.01 -45.03 75.17 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 117.673 -1.156 . . . . 10.0 109.271 -177.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.407 ' HB3' ' HB2' ' A' ' 3' ' ' ALA . . . -52.66 -31.3 36.34 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.796 1.18 . . . . 10.0 112.887 169.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.74 -36.55 31.89 Favored 'General case' 0 C--O 1.222 -0.342 0 O-C-N 120.694 -1.254 . . . . 10.0 112.1 -177.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.0 mt -74.24 -48.27 37.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 125.154 1.381 . . . . 10.0 111.281 174.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -27.75 67.2 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.414 1.086 . . . . 10.0 113.312 175.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 32.4 t80 -46.23 -38.72 8.81 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.666 0.617 . . . . 10.0 112.666 171.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.441 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -87.36 -71.29 0.57 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 122.946 0.498 . . . . 10.0 112.018 -177.356 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.3 t -160.13 36.49 0.17 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.495 0.718 . . . . 10.0 112.312 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.5 ptmm? 33.23 66.55 0.21 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 126.349 1.859 . . . . 10.0 114.796 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.548 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -163.17 -49.18 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.141 -0.936 . . . . 10.0 113.356 -178.209 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.4 ' HE3' ' CG ' ' A' ' 23' ' ' PRO . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.72 0 CA-C-O 118.089 -0.958 . . . . 10.0 111.511 179.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.539 0.526 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -151.87 121.07 6.73 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.191 0.996 . . . . 10.0 109.782 -174.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -42.83 -44.39 4.45 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.132 1.373 . . . . 10.0 113.693 170.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -55.96 -50.99 69.25 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.94 0.4 . . . . 10.0 110.312 175.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.33 -31.83 70.54 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.775 -0.578 . . . . 10.0 111.27 -176.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 44.1 mt -67.59 -51.94 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 178.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.24 -41.68 76.64 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 119.077 -1.049 . . . . 10.0 111.025 178.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -67.15 -21.42 65.82 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.315 1.446 . . . . 10.0 112.161 -177.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.41 -27.53 18.26 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.445 1.276 . . . . 10.0 114.445 166.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.69 -70.7 0.8 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.796 1.238 . . . . 10.0 111.582 -168.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.98 38.69 0.17 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.115 1.766 . . . . 10.0 110.224 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.9 t -119.26 -6.13 10.38 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 125.301 1.44 . . . . 10.0 113.833 -167.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.7 t -93.86 -38.06 9.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-O 122.322 1.058 . . . . 10.0 108.304 -175.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.6 m -110.83 -60.18 1.86 Allowed 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 126.474 1.909 . . . . 10.0 109.507 -167.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -74.49 -26.12 59.81 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 114.061 1.134 . . . . 10.0 114.061 -170.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 t -58.55 -55.0 40.72 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.966 0.906 . . . . 10.0 110.916 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.8 mmt -101.07 -23.87 14.41 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.645 1.178 . . . . 10.0 112.06 -178.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.64 52.93 2.7 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 124.92 1.248 . . . . 10.0 112.08 -174.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.7 t -93.25 156.17 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 125.389 1.475 . . . . 10.0 109.525 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.78 25.05 11.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.263 1.025 . . . . 10.0 113.106 -176.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.06 12.05 83.62 Favored Glycine 0 CA--C 1.535 1.306 0 C-N-CA 123.83 0.729 . . . . 10.0 113.206 -175.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.14 152.31 72.2 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 118.289 1.044 . . . . 10.0 111.995 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.26 169.51 21.85 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.739 2.959 . . . . 10.0 110.538 -177.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -78.07 146.68 35.11 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.634 -0.666 . . . . 10.0 112.382 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.17 -30.32 6.66 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.093 1.357 . . . . 10.0 113.976 168.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.6 p80 -146.44 114.92 6.75 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.045 -1.034 . . . . 10.0 110.006 174.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.412 HD22 ' CG ' ' A' ' 30' ' ' ASP . 5.3 m-20 -144.54 168.47 20.08 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.782 -1.192 . . . . 10.0 107.782 174.297 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 97.5 m -109.61 -32.38 7.13 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 119.294 -0.384 . . . . 10.0 110.955 167.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.57 -28.4 45.88 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 114.6 1.333 . . . . 10.0 114.6 -175.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.412 ' CG ' HD22 ' A' ' 27' ' ' ASN . 0.7 OUTLIER -81.15 -33.45 33.14 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.908 0.861 . . . . 10.0 109.498 176.061 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.452 ' CE3' ' HB2' ' A' ' 75' ' ' SER . 62.7 m95 -77.7 -41.08 39.21 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.155 0.982 . . . . 10.0 109.997 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -39.92 -65.04 0.46 Allowed Pre-proline 0 CA--C 1.549 0.907 0 CA-C-N 120.627 1.558 . . . . 10.0 114.9 174.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -70.9 -0.65 8.19 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 123.512 2.808 . . . . 10.0 113.495 -178.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.72 -34.67 9.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.311 1.444 . . . . 10.0 109.905 170.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 tp -98.53 20.68 12.38 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 128.228 2.611 . . . . 10.0 111.998 -173.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -106.89 16.29 24.48 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.638 1.575 . . . . 10.0 110.346 174.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -133.2 -45.3 0.84 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 126.434 1.894 . . . . 10.0 110.504 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 163.46 -142.59 7.96 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 109.343 -1.503 . . . . 10.0 109.343 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.1 t -129.75 -55.01 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 123.783 0.833 . . . . 10.0 109.737 -177.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.64 32.93 0.08 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.216 1.806 . . . . 10.0 113.294 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.2 m-20 -106.06 -46.56 4.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 128.151 2.58 . . . . 10.0 108.044 176.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 42' ' ' LEU . 1.4 mm? -83.17 -40.22 19.99 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.016 0.927 . . . . 10.0 111.51 -173.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 p -55.9 -26.6 21.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-O 121.612 0.72 . . . . 10.0 110.523 171.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.3 mmtt -72.6 -37.35 68.15 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.333 -0.854 . . . . 10.0 112.561 173.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.7 m -67.25 -32.98 74.37 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.973 0.892 . . . . 10.0 110.573 174.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.5 t -57.84 -49.33 81.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 O-C-N 121.443 -0.785 . . . . 10.0 111.858 171.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -28.45 69.66 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.062 0.764 . . . . 10.0 113.062 -177.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.0 p -83.59 -29.62 27.62 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.941 0.719 . . . . 10.0 112.941 174.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.0 101.22 0.33 Allowed Glycine 0 CA--C 1.527 0.818 0 CA-C-N 118.663 0.665 . . . . 10.0 112.445 -171.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.27 173.94 1.36 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.437 0.637 . . . . 10.0 111.141 165.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.525 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 10.3 m-80 -47.69 -57.88 4.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.439 1.496 . . . . 10.0 114.136 -167.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -99.26 23.48 9.15 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.359 1.464 . . . . 10.0 111.264 177.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -112.55 154.99 44.48 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 114.735 1.383 . . . . 10.0 114.735 172.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -76.06 134.44 16.1 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 122.782 2.321 . . . . 10.0 110.539 175.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -66.56 117.27 4.6 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.124 2.549 . . . . 10.0 110.288 178.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.76 30.91 10.7 Favored Glycine 0 C--N 1.343 0.926 0 C-N-CA 120.102 -1.047 . . . . 10.0 110.546 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.18 38.5 6.41 Favored Glycine 0 CA--C 1.531 1.054 0 CA-C-N 117.728 0.764 . . . . 10.0 114.482 178.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 73.48 -59.51 0.56 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.163 1.385 . . . . 10.0 111.367 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.4 t -82.76 98.31 9.03 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 125.151 1.38 . . . . 10.0 110.798 170.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.1 t -59.91 -42.11 93.16 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.422 169.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -79.41 57.22 2.32 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.036 1.334 . . . . 10.0 111.189 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.9 m -127.97 134.43 49.28 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 126.105 1.762 . . . . 10.0 110.975 -175.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 m -103.75 141.7 35.64 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.772 0.829 . . . . 10.0 109.942 -178.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -44.32 -34.95 2.13 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.028 1.121 . . . . 10.0 114.028 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -45.42 -56.65 4.78 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.502 1.121 . . . . 10.0 110.807 169.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.89 -44.59 26.64 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.434 1.494 . . . . 10.0 108.8 -175.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -47.43 85.65 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.012 1.325 . . . . 10.0 110.542 -174.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.0 mtpm? -69.48 -44.46 71.11 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.526 -0.733 . . . . 10.0 111.144 174.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.59 -27.41 6.75 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 119.288 0.949 . . . . 10.0 112.905 170.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.11 -46.48 11.9 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.139 -0.976 . . . . 10.0 110.656 173.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.2 tp -53.42 -34.94 23.86 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.695 1.198 . . . . 10.0 113.214 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.44 -17.95 29.34 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.288 1.435 . . . . 10.0 113.214 177.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -53.05 -44.99 67.85 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.402 -0.811 . . . . 10.0 111.941 174.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.3 mpp? -71.62 -62.19 1.5 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.479 1.112 . . . . 10.0 112.362 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.452 ' HB2' ' CE3' ' A' ' 31' ' ' TRP . 15.4 m -141.66 -93.84 0.14 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.215 1.006 . . . . 10.0 110.056 172.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.8 ptmt -174.89 56.11 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.984 1.313 . . . . 10.0 109.022 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.71 -75.38 0.05 Allowed 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 114.26 1.207 . . . . 10.0 114.26 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.41 ' HG3' ' CE3' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.186 0 N-CA-C 115.761 1.763 . . . . 10.0 115.761 -160.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.531 0.219 0 N-CA-C 112.47 0.544 . . . . 10.0 112.47 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -147.22 122.75 10.42 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.433 0.635 . . . . 10.0 109.459 -176.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -45.25 -40.77 7.81 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.794 1.238 . . . . 10.0 113.522 167.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -54.87 -50.82 67.76 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-N 118.117 0.417 . . . . 10.0 110.617 172.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.38 -31.52 70.95 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 122.022 -0.424 . . . . 10.0 110.647 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.75 -51.99 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 108.633 -0.877 . . . . 10.0 108.633 177.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.429 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.74 -41.95 74.59 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 118.951 -1.1 . . . . 10.0 111.251 -177.954 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -68.17 -22.05 64.86 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.809 1.644 . . . . 10.0 112.16 -177.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.42 -29.07 16.47 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.932 1.086 . . . . 10.0 113.932 166.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -106.05 -67.27 0.94 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.263 1.025 . . . . 10.0 112.933 -170.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.429 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.73 43.05 0.39 Allowed 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.883 1.273 . . . . 10.0 109.374 -179.1 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 t -126.79 -5.0 6.37 Favored 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 125.333 1.453 . . . . 10.0 113.501 -165.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 41.2 t -99.02 -51.63 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 124.985 1.314 . . . . 10.0 108.083 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 80.4 m -92.01 -59.01 2.21 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.426 1.891 . . . . 10.0 109.906 -174.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 -73.97 -16.92 61.06 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.033 1.123 . . . . 10.0 114.033 -171.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.7 t -65.34 -50.01 67.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.766 -0.584 . . . . 10.0 111.24 -178.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 tpt -106.96 -26.27 11.26 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.291 1.036 . . . . 10.0 112.256 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.78 55.22 1.33 Allowed Glycine 0 CA--C 1.535 1.343 0 C-N-CA 125.211 1.386 . . . . 10.0 111.9 -174.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 90.8 t -95.6 156.46 3.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 125.291 1.437 . . . . 10.0 109.69 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.12 25.95 11.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.218 1.007 . . . . 10.0 112.802 -174.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.74 7.44 88.21 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.105 0.86 . . . . 10.0 113.508 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.43 147.03 92.73 Favored Pre-proline 0 CA--C 1.55 0.977 0 CA-C-N 118.807 1.304 . . . . 10.0 112.35 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -67.12 172.23 10.22 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 125.099 3.866 . . . . 10.0 110.29 172.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -124.26 135.33 53.33 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.763 0.825 . . . . 10.0 111.52 -176.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 p -78.79 52.89 1.28 Allowed 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.825 -1.172 . . . . 10.0 113.166 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -146.54 -43.3 0.19 Allowed 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.885 1.439 . . . . 10.0 114.885 178.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.67 146.13 32.62 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.932 1.293 . . . . 10.0 108.877 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 38.2 m -94.44 -29.0 15.19 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.253 0.933 . . . . 10.0 110.155 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.46 -29.85 68.1 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.689 0.996 . . . . 10.0 113.689 177.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.458 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 60.7 t0 -71.32 -34.03 70.2 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.434 1.094 . . . . 10.0 109.26 174.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.434 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 49.0 m95 -90.03 -31.27 17.26 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 125.094 1.358 . . . . 10.0 113.254 -175.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -47.01 -56.59 11.48 Favored Pre-proline 0 CA--C 1.541 0.613 0 O-C-N 120.493 -1.379 . . . . 10.0 114.603 174.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.43 -0.02 4.59 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 122.579 2.186 . . . . 10.0 113.278 -178.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -93.6 -49.19 6.0 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.499 -0.751 . . . . 10.0 109.567 170.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.36 22.8 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.533 1.308 . . . . 10.0 114.533 170.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -93.94 -37.76 11.53 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.396 1.078 . . . . 10.0 109.698 176.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt -85.83 -46.01 11.04 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.948 0.899 . . . . 10.0 111.151 175.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 152.81 -143.58 10.46 Favored Glycine 0 CA--C 1.534 1.248 0 N-CA-C 110.353 -1.099 . . . . 10.0 110.353 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.8 t -123.76 -54.53 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.194 0.998 . . . . 10.0 110.901 -174.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.95 -13.85 7.6 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.443 1.497 . . . . 10.0 113.207 -178.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -72.84 -16.04 61.61 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 126.093 1.757 . . . . 10.0 113.47 175.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 mp -103.9 -43.99 5.16 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.228 0.611 . . . . 10.0 110.379 -171.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.3 p -53.8 -34.15 24.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.05 0.54 . . . . 10.0 111.103 170.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.6 ptmt -63.51 -43.96 95.68 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.823 -1.173 . . . . 10.0 113.91 170.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.5 m -66.55 -32.72 74.24 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 120.631 -1.293 . . . . 10.0 110.034 -178.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 40.5 t -60.43 -54.89 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 123.563 0.745 . . . . 10.0 111.099 172.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.62 -31.9 69.92 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.903 0.705 . . . . 10.0 112.903 178.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.8 m -71.1 -27.48 63.62 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.442 0.697 . . . . 10.0 112.471 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 74.31 90.68 0.17 Allowed Glycine 0 CA--C 1.529 0.969 0 CA-C-N 119.196 0.907 . . . . 10.0 112.539 -175.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.41 168.51 2.71 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.961 0.886 . . . . 10.0 111.634 173.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.493 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 8.5 m-80 -52.98 -57.96 8.58 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 120.468 -1.395 . . . . 10.0 112.85 -169.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.6 17.94 3.04 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.189 1.396 . . . . 10.0 112.722 173.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ttp -131.66 130.26 22.31 Favored Pre-proline 0 CA--C 1.545 0.763 0 N-CA-C 115.021 1.489 . . . . 10.0 115.021 -175.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.08 143.04 76.98 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 121.452 1.434 . . . . 10.0 112.309 -178.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -61.92 133.06 42.53 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 123.679 2.919 . . . . 10.0 109.946 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.79 11.75 85.13 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 119.579 -1.296 . . . . 10.0 112.735 -173.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 56.81 53.94 40.32 Favored Glycine 0 CA--C 1.532 1.138 0 O-C-N 120.74 -1.447 . . . . 10.0 110.88 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 80.12 -45.52 0.29 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.835 2.054 . . . . 10.0 112.603 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.08 162.39 25.89 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.642 0.777 . . . . 10.0 111.583 175.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.7 m -114.42 -57.41 2.28 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.315 1.046 . . . . 10.0 110.504 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -82.48 68.03 8.76 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 122.418 1.104 . . . . 10.0 109.871 -178.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.76 116.79 32.34 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.837 1.655 . . . . 10.0 110.432 -177.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -84.48 130.63 34.74 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 126.557 1.943 . . . . 10.0 109.334 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -45.58 -35.72 4.19 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.898 0.879 . . . . 10.0 113.261 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -50.17 -59.76 3.62 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.187 0.995 . . . . 10.0 113.162 167.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -74.62 -26.47 59.92 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 120.961 -1.087 . . . . 10.0 109.907 -177.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -55.82 14.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.909 1.284 . . . . 10.0 110.959 177.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.55 -44.49 96.93 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 177.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.75 -24.96 38.34 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.412 0.523 . . . . 10.0 112.412 173.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -85.61 -48.0 9.3 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.534 -0.729 . . . . 10.0 109.86 176.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.2 tp -57.42 -30.33 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.705 1.602 . . . . 10.0 112.747 178.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.63 -28.56 23.14 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.205 1.002 . . . . 10.0 113.549 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -51.87 -51.35 57.33 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.431 1.014 . . . . 10.0 112.139 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.434 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.3 mpp? -64.96 -36.87 85.78 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.718 0.636 . . . . 10.0 112.718 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -166.8 -74.18 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.465 0.706 . . . . 10.0 110.934 172.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 164.1 43.58 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 128.281 2.632 . . . . 10.0 110.842 -170.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.63 -81.58 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 115.418 1.636 . . . . 10.0 115.418 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.458 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 3.0 ptpt . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.282 -1.342 . . . . 10.0 113.925 -176.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.535 0.372 0 CA-C-O 120.064 -0.017 . . . . 10.0 111.013 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 58.5 t0 -149.52 119.82 7.32 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.198 0.999 . . . . 10.0 110.007 173.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -44.52 -42.34 7.12 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.004 1.321 . . . . 10.0 113.93 167.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -57.94 -46.58 84.83 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 122.208 -0.307 . . . . 10.0 110.428 173.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.41 -34.18 76.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.963 -0.461 . . . . 10.0 110.701 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.5 mm -64.86 -51.25 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 O-C-N 121.575 -0.703 . . . . 10.0 109.143 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.414 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.1 -42.01 76.68 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 117.791 -1.563 . . . . 10.0 111.988 179.514 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.61 -22.0 64.47 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.513 1.525 . . . . 10.0 112.579 -176.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -92.64 -29.21 16.24 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.548 1.139 . . . . 10.0 113.249 170.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.18 -64.49 1.29 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.143 0.977 . . . . 10.0 112.995 -170.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.414 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.04 37.81 0.16 Allowed 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.811 1.244 . . . . 10.0 110.887 178.184 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -120.57 -1.35 10.1 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 125.024 1.329 . . . . 10.0 113.316 -165.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.2 t -105.66 -46.57 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 124.647 1.179 . . . . 10.0 108.874 -171.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.9 m -87.82 -64.52 1.14 Allowed 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 125.703 1.601 . . . . 10.0 111.571 174.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -72.57 -25.57 61.4 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.565 0.746 . . . . 10.0 112.993 -162.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.8 t -55.01 -50.31 69.36 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.874 1.269 . . . . 10.0 111.094 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.5 tpt -106.08 -21.29 13.17 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.945 0.898 . . . . 10.0 112.635 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.56 45.27 3.76 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.138 0.875 . . . . 10.0 112.353 -176.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 57.7 t -86.06 160.18 3.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 124.568 1.147 . . . . 10.0 109.384 177.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.97 17.16 5.15 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.806 1.243 . . . . 10.0 113.531 -175.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.84 18.38 78.91 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.128 0.87 . . . . 10.0 113.417 -173.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.0 143.55 98.02 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-N 118.507 1.154 . . . . 10.0 112.831 -177.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -66.96 147.47 80.31 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.142 3.228 . . . . 10.0 110.118 177.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -69.1 139.49 54.77 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.792 -167.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 72.4 m -37.96 -35.3 0.15 Allowed 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.48 1.512 . . . . 10.0 114.512 173.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -141.94 108.75 5.4 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.737 1.615 . . . . 10.0 107.862 174.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -135.28 167.28 21.31 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.757 1.623 . . . . 10.0 106.737 171.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 88.2 m -110.84 -35.77 5.87 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.385 0.539 . . . . 10.0 112.123 171.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.05 -17.19 44.13 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 121.119 -0.988 . . . . 10.0 113.072 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -85.23 -29.77 24.39 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.272 1.829 . . . . 10.0 110.114 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.462 ' CZ3' ' HB2' ' A' ' 74' ' ' MET . 50.4 m95 -92.61 -38.34 11.94 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.869 2.068 . . . . 10.0 111.204 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -41.78 -60.52 1.89 Allowed Pre-proline 0 CA--C 1.552 1.038 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 173.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -64.24 -4.79 8.43 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.561 2.841 . . . . 10.0 114.053 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -98.25 -53.02 3.48 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.748 1.619 . . . . 10.0 108.308 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.475 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 1.4 mt -58.9 -19.39 41.79 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.566 1.547 . . . . 10.0 113.338 174.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.16 -30.58 55.07 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.143 1.377 . . . . 10.0 109.488 -177.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -82.57 -52.2 7.05 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.854 -0.424 . . . . 10.0 109.854 174.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.531 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 167.99 -125.26 1.28 Allowed Glycine 0 CA--C 1.532 1.106 0 N-CA-C 111.339 -0.704 . . . . 10.0 111.339 177.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.7 t -141.61 -59.71 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-O 122.105 0.955 . . . . 10.0 109.461 -178.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -71.69 17.35 0.09 Allowed 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 124.277 1.031 . . . . 10.0 112.652 -173.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.531 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -98.43 -18.36 18.29 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 128.249 2.62 . . . . 10.0 110.39 177.366 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -101.51 -41.92 6.44 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.999 0.92 . . . . 10.0 111.053 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.3 p -49.62 -35.38 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-O 121.477 0.656 . . . . 10.0 111.264 170.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 ptmt -63.66 -44.39 93.91 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 114.707 1.373 . . . . 10.0 114.707 172.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.14 -23.61 63.03 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 119.156 0.889 . . . . 10.0 110.91 178.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.0 t -67.33 -53.92 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 O-C-N 121.584 -0.697 . . . . 10.0 111.703 168.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.51 -34.82 74.65 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.949 -0.469 . . . . 10.0 112.035 177.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.64 -31.32 61.92 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.39 0.676 . . . . 10.0 112.169 177.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.0 105.5 0.15 Allowed Glycine 0 C--N 1.341 0.808 0 N-CA-C 111.485 -0.646 . . . . 10.0 111.485 -166.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.5 tp -63.14 172.01 2.04 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.877 -0.778 . . . . 10.0 110.247 167.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.505 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 7.8 m-80 -49.02 -58.27 5.18 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.742 1.217 . . . . 10.0 113.488 -169.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -86.09 18.97 2.81 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.018 1.327 . . . . 10.0 112.923 174.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 5.9 mtp -119.24 147.28 42.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 N-CA-C 114.269 1.211 . . . . 10.0 114.269 173.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.29 141.44 32.13 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.137 1.891 . . . . 10.0 110.425 172.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -61.6 124.36 14.48 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.003 2.469 . . . . 10.0 109.884 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.67 17.03 57.52 Favored Glycine 0 C--N 1.34 0.776 0 C-N-CA 119.994 -1.098 . . . . 10.0 111.824 -178.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 52.93 36.3 50.51 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 118.875 1.337 . . . . 10.0 113.511 172.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 66.54 21.99 10.65 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.323 1.849 . . . . 10.0 114.102 -175.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.9 t -122.74 166.61 14.65 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.287 1.835 . . . . 10.0 110.577 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.8 t -115.47 -55.59 2.43 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.393 1.077 . . . . 10.0 111.551 177.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -115.43 49.97 1.04 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.714 1.206 . . . . 10.0 110.99 -177.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.9 m -80.09 117.54 20.99 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 120.394 -1.441 . . . . 10.0 110.624 174.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 34.7 p -79.7 139.0 37.51 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -45.51 -32.22 2.14 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.757 0.823 . . . . 10.0 113.202 176.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -52.61 -61.8 2.05 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 119.257 0.935 . . . . 10.0 112.535 169.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -27.77 62.39 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.551 -0.718 . . . . 10.0 110.495 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -50.02 45.45 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.46 1.124 . . . . 10.0 109.972 -177.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -64.85 -51.65 60.88 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 124.58 1.152 . . . . 10.0 109.021 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.43 -35.07 12.07 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 118.871 0.759 . . . . 10.0 112.523 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.27 -34.04 61.31 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 120.946 -1.096 . . . . 10.0 112.213 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.65 -51.57 27.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.048 1.739 . . . . 10.0 110.7 175.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.6 -28.32 69.84 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.033 1.333 . . . . 10.0 112.881 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -42.16 -41.34 2.64 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.884 0.698 . . . . 10.0 112.884 170.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.462 ' HB2' ' CZ3' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -77.59 -69.77 0.52 Allowed 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 111.998 0.369 . . . . 10.0 111.998 179.854 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.8 t -163.08 32.23 0.09 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.685 0.995 . . . . 10.0 113.685 -176.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 37.29 53.95 1.3 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.443 1.897 . . . . 10.0 115.047 177.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.475 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -140.77 -54.64 0.5 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.923 0.889 . . . . 10.0 112.836 -177.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.408 ' HG3' ' CE3' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.898 0 CA-C-O 116.666 -1.635 . . . . 10.0 110.559 171.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.522 0 N-CA-C 114.281 1.215 . . . . 10.0 114.281 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -136.93 -168.09 2.21 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 106.218 -1.771 . . . . 10.0 106.218 -177.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -103.34 -41.75 5.93 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 127.522 2.329 . . . . 10.0 111.998 176.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -54.85 -51.5 65.7 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 122.195 0.997 . . . . 10.0 109.772 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.96 -30.08 69.28 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.144 -0.935 . . . . 10.0 110.858 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.56 -52.0 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.404 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.5 OUTLIER -69.71 -40.08 76.49 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.758 0.708 . . . . 10.0 110.39 -176.769 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -68.94 -23.95 64.21 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.391 1.077 . . . . 10.0 112.035 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.41 -30.66 19.32 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.612 1.338 . . . . 10.0 114.612 166.335 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.65 -69.54 0.86 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.959 1.304 . . . . 10.0 111.637 -167.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.404 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.38 43.95 0.25 Allowed 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 125.516 1.526 . . . . 10.0 110.345 178.612 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.9 t -127.1 -7.13 5.98 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.701 1.601 . . . . 10.0 113.668 -167.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 48.4 t -94.17 -42.72 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 N-CA-C 108.243 -1.021 . . . . 10.0 108.243 -175.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.9 m -104.97 -57.2 2.06 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.737 1.615 . . . . 10.0 109.358 -173.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -74.13 -14.77 61.02 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 114.825 1.417 . . . . 10.0 114.825 -171.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.6 t -70.24 -43.99 69.44 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.434 0.693 . . . . 10.0 110.408 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 25.5 mmt -114.64 -40.42 3.58 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.271 1.428 . . . . 10.0 112.247 -175.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.21 61.67 1.13 Allowed Glycine 0 CA--C 1.535 1.322 0 C-N-CA 125.737 1.637 . . . . 10.0 112.682 -178.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 94.0 t -82.65 -56.53 5.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 121.631 0.729 . . . . 10.0 111.991 -175.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.97 30.79 0.44 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.909 0.884 . . . . 10.0 111.211 177.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 65.83 18.41 66.32 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 124.026 0.822 . . . . 10.0 113.195 -172.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.23 142.88 97.79 Favored Pre-proline 0 CA--C 1.539 0.536 0 O-C-N 121.681 -0.894 . . . . 10.0 111.676 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -75.27 149.38 35.55 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 122.841 2.361 . . . . 10.0 111.182 -172.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -63.58 134.5 55.6 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.041 -0.527 . . . . 10.0 112.34 -175.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.1 p -48.08 -22.96 0.7 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.079 1.752 . . . . 10.0 114.453 173.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.76 40.14 1.84 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.135 0.879 . . . . 10.0 113.125 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -77.09 151.36 35.48 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.524 -0.735 . . . . 10.0 110.607 169.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.3 m -107.51 -30.57 8.56 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.704 0.402 . . . . 10.0 110.978 165.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.63 -36.58 70.78 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.945 -1.097 . . . . 10.0 113.179 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -79.23 -30.18 43.09 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.91 0.862 . . . . 10.0 110.281 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.9 m95 -82.48 -31.56 29.28 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.967 1.707 . . . . 10.0 111.751 178.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -40.7 -62.04 1.08 Allowed Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.07 1.348 . . . . 10.0 113.954 172.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.17 6.66 2.08 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.851 2.367 . . . . 10.0 113.787 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.482 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 29.2 mmt180 -108.49 -42.63 4.51 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.18 1.392 . . . . 10.0 109.345 177.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.05 6.12 2.32 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.081 1.752 . . . . 10.0 112.823 176.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.19 -34.96 37.01 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.53 1.532 . . . . 10.0 109.205 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -80.92 -61.01 2.09 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.3 170.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 150.17 -127.94 2.54 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.428 -0.669 . . . . 10.0 111.428 175.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.9 m -122.42 172.77 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 126.331 1.852 . . . . 10.0 109.172 175.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 63.15 9.5 3.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.838 1.255 . . . . 10.0 113.832 -176.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -92.63 -62.14 1.45 Allowed 'General case' 0 C--N 1.343 0.295 0 CA-C-O 122.419 1.104 . . . . 10.0 108.913 170.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.66 -26.66 60.01 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.734 0.814 . . . . 10.0 111.468 -172.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.01 -29.43 46.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 O-C-N 121.611 -0.681 . . . . 10.0 110.371 173.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -69.28 -43.0 74.76 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.538 -0.727 . . . . 10.0 110.976 176.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -39.09 93.08 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.507 -0.746 . . . . 10.0 109.939 176.196 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.431 HG12 ' CZ ' ' A' ' 67' ' ' TYR . 2.4 t -56.12 -48.55 78.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.407 0.623 . . . . 10.0 111.85 178.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.97 -32.01 72.97 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.896 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 54.6 m -74.47 -29.66 61.54 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.083 0.953 . . . . 10.0 113.547 175.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.29 117.98 0.35 Allowed Glycine 0 CA--C 1.529 0.962 0 CA-C-N 119.306 0.957 . . . . 10.0 111.496 -170.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.6 tp -72.56 -145.3 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.162 0.985 . . . . 10.0 110.628 168.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -80.64 -67.24 0.79 Allowed 'General case' 0 N--CA 1.477 0.893 0 O-C-N 119.648 -1.907 . . . . 10.0 111.301 -174.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.2 -14.74 60.14 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.276 1.43 . . . . 10.0 111.381 176.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 ttp -97.67 120.44 60.48 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 123.726 0.81 . . . . 10.0 110.862 -175.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -70.74 157.22 59.11 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 121.718 1.612 . . . . 10.0 111.31 -175.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -62.49 116.88 3.8 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 123.031 2.488 . . . . 10.0 110.23 -179.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 98.49 35.91 4.78 Favored Glycine 0 C--N 1.344 1.018 0 CA-C-N 118.058 0.39 . . . . 10.0 113.104 -176.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 53.39 -86.66 0.01 OUTLIER Glycine 0 CA--C 1.537 1.425 0 C-N-CA 124.533 1.063 . . . . 10.0 113.998 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.6 ttt -171.98 40.16 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 127.242 2.217 . . . . 10.0 110.226 172.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.8 p -131.29 170.76 14.17 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.56 1.319 . . . . 10.0 114.56 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 55.3 m -81.99 -98.77 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.928 1.291 . . . . 10.0 109.966 175.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -82.35 64.29 6.94 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.957 -1.089 . . . . 10.0 109.434 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 4.2 m -60.75 86.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.807 0 CA-C-O 121.301 0.572 . . . . 10.0 111.495 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.3 p -78.23 132.27 37.48 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 120.776 -1.203 . . . . 10.0 108.186 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -46.77 -32.04 3.4 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.966 0.906 . . . . 10.0 112.515 178.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -52.72 -59.48 4.43 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.327 1.451 . . . . 10.0 113.968 166.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -73.89 -36.07 64.75 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 107.932 -1.136 . . . . 10.0 107.932 -175.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.431 ' CZ ' HG12 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -55.92 -60.24 3.75 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 123.165 0.586 . . . . 10.0 111.064 172.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.8 ptmt -57.82 -48.32 80.09 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.338 1.055 . . . . 10.0 109.873 -177.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.94 -22.25 14.42 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.758 0.651 . . . . 10.0 112.758 172.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -101.79 -9.82 20.46 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 124.701 1.2 . . . . 10.0 113.859 -174.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.412 HG22 ' O ' ' A' ' 67' ' ' TYR . 0.0 OUTLIER -99.94 -38.76 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.962 0.905 . . . . 10.0 109.809 167.36 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -37.93 77.36 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.322 0.649 . . . . 10.0 111.698 175.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -49.93 -38.56 36.85 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.015 0.926 . . . . 10.0 112.462 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -79.35 -65.17 1.03 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.625 0.37 . . . . 10.0 111.991 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 t -164.3 27.94 0.07 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 119.451 -0.9 . . . . 10.0 112.917 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt 40.0 46.81 1.84 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.784 0.834 . . . . 10.0 113.134 -175.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.482 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -132.64 -84.66 0.47 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.887 1.275 . . . . 10.0 113.435 173.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.277 0 N-CA-C 115.651 1.722 . . . . 10.0 115.651 -164.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 8.4 mp0 . . . . . 0 CA--C 1.528 0.129 0 N-CA-C 112.144 0.424 . . . . 10.0 112.144 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -141.62 123.38 15.22 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 108.636 -0.876 . . . . 10.0 108.636 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -54.1 -36.1 62.84 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 124.134 0.974 . . . . 10.0 112.679 172.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -59.04 -47.41 85.34 Favored 'General case' 0 C--N 1.34 0.17 0 N-CA-C 110.426 -0.212 . . . . 10.0 110.426 170.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.78 -34.33 76.58 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.743 -0.598 . . . . 10.0 110.621 -178.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.402 ' CD1' ' HB3' ' A' ' 66' ' ' ASP . 33.8 mt -64.37 -51.61 66.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 N-CA-C 108.428 -0.952 . . . . 10.0 108.428 178.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.492 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -69.29 -42.3 75.66 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 117.695 -1.602 . . . . 10.0 112.294 -179.757 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -68.86 -22.48 64.2 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.641 1.576 . . . . 10.0 112.752 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -94.78 -28.8 15.09 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.95 0.722 . . . . 10.0 112.95 170.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -108.11 -64.94 1.16 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.052 0.941 . . . . 10.0 112.562 -171.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.42 44.16 0.34 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.742 1.217 . . . . 10.0 110.483 179.278 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.5 t -129.8 -6.32 4.55 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 124.883 1.273 . . . . 10.0 113.794 -164.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.6 t -97.11 -46.74 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 124.779 1.231 . . . . 10.0 108.236 -176.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 82.3 m -92.07 -63.68 1.21 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 127.582 2.353 . . . . 10.0 110.507 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -73.61 -20.92 60.46 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.961 1.097 . . . . 10.0 113.961 -167.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.8 t -57.82 -53.59 56.46 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.505 1.122 . . . . 10.0 111.394 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.0 tpt -108.91 -12.78 14.84 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.768 0.827 . . . . 10.0 112.422 -178.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.42 40.84 7.64 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.266 0.936 . . . . 10.0 112.264 -175.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 68.8 t -80.08 155.91 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.469 1.108 . . . . 10.0 109.149 176.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 55.6 21.63 4.65 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.772 1.229 . . . . 10.0 113.619 -176.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.87 20.52 76.02 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 124.231 0.919 . . . . 10.0 113.842 -176.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.83 141.77 79.22 Favored Pre-proline 0 CA--C 1.547 0.856 0 CA-C-N 118.64 1.22 . . . . 10.0 113.681 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.31 132.7 13.97 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 124.763 3.642 . . . . 10.0 111.815 -176.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -61.49 142.77 56.8 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.705 -1.247 . . . . 10.0 113.835 -161.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.0 m -50.83 -33.59 24.27 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.347 0.869 . . . . 10.0 113.347 176.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -125.63 117.61 23.9 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.248 1.019 . . . . 10.0 108.698 167.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -151.8 163.55 38.94 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.278 1.831 . . . . 10.0 106.838 172.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 96.5 m -110.08 -36.6 5.81 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.45 0.568 . . . . 10.0 111.138 170.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.95 -19.61 34.34 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.501 -0.749 . . . . 10.0 113.02 -175.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -83.09 -34.08 26.22 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.279 1.432 . . . . 10.0 110.283 178.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.431 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 63.7 m95 -82.24 -40.73 21.2 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.233 1.813 . . . . 10.0 111.624 176.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -39.49 -60.11 1.39 Allowed Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 114.496 1.295 . . . . 10.0 114.496 175.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -65.04 -8.3 17.87 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.389 2.726 . . . . 10.0 114.151 -177.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -95.77 -53.48 3.69 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.845 0.858 . . . . 10.0 110.152 170.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.47 -18.88 4.76 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.641 1.577 . . . . 10.0 113.394 178.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.63 -32.81 36.14 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.637 1.575 . . . . 10.0 109.993 -176.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.54 -46.65 12.18 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.876 -0.787 . . . . 10.0 108.876 174.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.446 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 163.88 -142.82 8.09 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 110.892 -0.883 . . . . 10.0 110.892 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.4 t -134.63 -56.27 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 122.707 1.241 . . . . 10.0 109.673 -174.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.67 -29.86 28.76 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 127.167 2.187 . . . . 10.0 111.232 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.446 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -55.92 -20.12 14.8 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.421 1.888 . . . . 10.0 113.916 175.3 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -103.13 -43.53 5.45 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.844 0.858 . . . . 10.0 111.061 -175.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 p -53.69 -34.07 23.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 118.119 0.418 . . . . 10.0 111.185 171.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -59.29 -48.55 81.21 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.099 1.148 . . . . 10.0 114.099 167.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.9 m -62.86 -35.14 79.0 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 120.617 -1.302 . . . . 10.0 110.152 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 28.5 t -58.04 -54.18 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.055 173.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.5 ptmt -61.83 -33.74 74.7 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.573 0.582 . . . . 10.0 112.573 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 97.6 m -72.01 -33.54 68.14 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.48 0.712 . . . . 10.0 112.37 -178.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.54 98.34 0.42 Allowed Glycine 0 CA--C 1.531 1.08 0 CA-C-N 118.809 0.731 . . . . 10.0 111.929 -173.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 5.0 tp -67.48 170.13 8.01 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.279 1.031 . . . . 10.0 111.106 174.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.474 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 6.7 m-80 -52.68 -57.65 9.38 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.736 -1.228 . . . . 10.0 112.365 -171.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.32 20.9 9.74 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.33 1.452 . . . . 10.0 112.383 172.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 40.3 ttp -125.6 125.34 25.01 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 114.001 1.112 . . . . 10.0 114.001 172.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -61.87 151.22 82.44 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.868 1.712 . . . . 10.0 111.925 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -61.57 140.15 85.36 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 123.171 2.58 . . . . 10.0 110.677 -177.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.75 30.76 73.43 Favored Glycine 0 CA--C 1.53 1.008 0 CA-C-N 116.502 -0.317 . . . . 10.0 112.734 -170.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.51 36.27 5.93 Favored Glycine 0 CA--C 1.536 1.396 0 O-C-N 121.693 -0.886 . . . . 10.0 114.314 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.2 ttt 84.93 12.41 0.26 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.936 2.094 . . . . 10.0 114.685 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.7 m -106.35 167.52 9.78 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.594 1.158 . . . . 10.0 112.338 171.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.1 m -131.19 -49.48 1.01 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.882 1.673 . . . . 10.0 110.167 171.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -79.43 -29.77 42.02 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.414 1.486 . . . . 10.0 112.693 -175.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 21.9 m -55.21 122.29 10.73 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.108 1.763 . . . . 10.0 111.197 179.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.0 m -103.0 162.22 13.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.55 1.94 . . . . 10.0 109.539 -176.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -44.98 -44.77 10.14 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.788 -1.195 . . . . 10.0 113.627 176.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -50.0 -40.11 43.34 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.838 0.855 . . . . 10.0 112.248 174.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.402 ' HB3' ' CD1' ' A' ' 6' ' ' ILE . 0.4 OUTLIER -84.46 -44.08 14.0 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.619 0.767 . . . . 10.0 111.154 178.239 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -58.03 -50.2 74.23 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.895 -1.128 . . . . 10.0 112.285 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -58.41 -46.52 86.29 Favored 'General case' 0 N--CA 1.463 0.216 0 O-C-N 121.783 -0.573 . . . . 10.0 110.027 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.5 -34.34 64.52 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 121.923 0.868 . . . . 10.0 112.858 170.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.34 -41.28 63.65 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 120.222 -1.549 . . . . 10.0 111.456 -178.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.2 pt -75.69 -33.13 25.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 O-C-N 121.646 -0.659 . . . . 10.0 112.634 175.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -69.86 -32.69 71.2 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.566 -0.709 . . . . 10.0 111.206 174.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -48.51 -48.34 38.22 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 119.092 0.86 . . . . 10.0 111.167 172.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.413 ' HB3' ' CZ2' ' A' ' 31' ' ' TRP . 73.3 mtm -71.76 -51.82 20.76 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.748 -0.66 . . . . 10.0 112.152 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -154.15 -79.29 0.1 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 117.595 0.18 . . . . 10.0 111.317 173.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 161.48 47.05 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.595 2.758 . . . . 10.0 110.68 -176.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.2 -88.58 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.478 0.918 . . . . 10.0 113.478 175.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.431 ' HE2' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.136 0 N-CA-C 115.205 1.557 . . . . 10.0 115.205 -172.061 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.49 0 N-CA-C 114.036 1.125 . . . . 10.0 114.036 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.45 ' O ' HD13 ' A' ' 6' ' ' ILE . 47.4 t0 -143.5 -164.2 1.81 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.775 2.03 . . . . 10.0 107.193 -174.034 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.75 -44.26 4.07 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 127.29 2.236 . . . . 10.0 111.664 172.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -58.84 -48.35 81.65 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.941 -0.474 . . . . 10.0 111.649 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.44 -28.61 68.74 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.336 -0.852 . . . . 10.0 110.96 -177.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.45 HD13 ' O ' ' A' ' 2' ' ' ASP . 1.4 mp -69.24 -51.65 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.128 -1.064 . . . . 10.0 108.128 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.431 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.4 OUTLIER -68.34 -41.95 79.99 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 118.026 -1.47 . . . . 10.0 111.747 177.093 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -67.97 -22.11 65.04 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.956 1.702 . . . . 10.0 112.778 -176.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.58 -28.42 16.04 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.838 1.051 . . . . 10.0 113.838 167.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -105.73 -67.77 0.91 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.131 0.972 . . . . 10.0 112.057 -171.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.431 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.04 41.86 0.3 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 125.251 1.42 . . . . 10.0 110.365 -179.029 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -128.46 -7.11 5.23 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 125.657 1.583 . . . . 10.0 113.283 -167.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.2 t -94.52 -39.97 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.134 0.973 . . . . 10.0 108.54 -176.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.7 m -106.93 -55.71 2.29 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.779 1.632 . . . . 10.0 110.629 -172.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . 0.445 ' CE1' ' HG2' ' A' ' 23' ' ' PRO . 20.0 m-70 -75.19 -19.67 59.69 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.665 1.357 . . . . 10.0 114.665 -172.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m -65.45 -51.64 58.76 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.464 0.705 . . . . 10.0 110.237 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.71 -34.59 10.47 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.092 1.357 . . . . 10.0 111.595 -177.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.09 57.74 1.0 Allowed Glycine 0 CA--C 1.537 1.451 0 C-N-CA 126.296 1.903 . . . . 10.0 112.508 -174.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 18.5 t -94.9 153.68 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 124.769 1.227 . . . . 10.0 110.435 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.09 20.84 5.85 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.241 1.416 . . . . 10.0 113.528 -177.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.9 22.31 69.27 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.561 1.077 . . . . 10.0 113.571 -173.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.69 143.14 94.69 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 118.516 1.158 . . . . 10.0 112.606 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.445 ' HG2' ' CE1' ' A' ' 15' ' ' HIS . 96.4 Cg_endo -74.22 146.99 36.93 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 124.776 3.651 . . . . 10.0 110.571 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -74.54 135.45 42.15 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.812 -0.555 . . . . 10.0 111.657 -167.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.66 -34.12 4.81 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.651 1.18 . . . . 10.0 113.472 178.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 48.8 p-80 -125.32 103.57 8.0 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.803 1.641 . . . . 10.0 108.971 170.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -141.24 161.8 37.02 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 107.182 -1.414 . . . . 10.0 107.182 170.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 59.7 m -109.94 -35.6 6.1 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.408 0.549 . . . . 10.0 111.35 171.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.48 -12.65 45.38 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.295 -0.878 . . . . 10.0 113.293 -177.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.446 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 13.7 t0 -88.58 -25.77 22.31 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.641 1.576 . . . . 10.0 109.898 174.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.467 ' CZ3' ' OXT' ' A' ' 78' ' ' LYS . 63.4 m95 -96.68 -35.06 11.15 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.719 1.608 . . . . 10.0 111.095 -179.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.07 -52.64 19.14 Favored Pre-proline 0 CA--C 1.549 0.941 0 N-CA-C 114.694 1.368 . . . . 10.0 114.694 169.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -74.83 16.18 0.66 Allowed 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.933 2.422 . . . . 10.0 113.641 -179.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 -122.07 -45.05 2.26 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.78 2.032 . . . . 10.0 108.827 176.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.519 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -59.41 0.96 0.09 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.054 1.742 . . . . 10.0 114.433 166.877 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -81.11 -27.08 35.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.98 1.312 . . . . 10.0 109.842 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -90.42 -57.08 2.96 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.4 0.68 . . . . 10.0 110.492 173.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 148.9 -115.69 0.75 Allowed Glycine 0 CA--C 1.531 1.083 0 C-N-CA 123.845 0.736 . . . . 10.0 111.279 174.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.52 173.79 13.47 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.163 0 C-N-CA 125.064 1.346 . . . . 10.0 110.893 171.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.258 16.0 m-20 69.3 -27.51 0.16 Allowed 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 125.48 1.512 . . . . 10.0 112.877 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.67 -26.86 68.86 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.014 -1.678 . . . . 10.0 113.859 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -99.55 -38.51 8.73 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.623 0.769 . . . . 10.0 111.07 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -54.52 -33.99 27.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 122.015 -0.428 . . . . 10.0 110.25 172.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 ptmt -59.11 -46.97 86.96 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.916 1.08 . . . . 10.0 113.916 169.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 55.5 m -68.53 -28.38 66.93 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 120.59 -1.319 . . . . 10.0 110.547 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.3 t -60.24 -54.06 40.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 O-C-N 121.657 -0.652 . . . . 10.0 111.481 170.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -33.84 73.5 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 111.951 0.352 . . . . 10.0 111.951 177.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.03 -35.39 66.76 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.514 0.561 . . . . 10.0 112.514 -178.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.74 112.67 0.21 Allowed Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.255 -0.738 . . . . 10.0 111.255 -167.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.6 -155.23 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.578 0.751 . . . . 10.0 110.523 170.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -73.13 -66.58 0.66 Allowed 'General case' 0 N--CA 1.475 0.802 0 O-C-N 119.67 -1.894 . . . . 10.0 111.608 -173.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.31 -16.51 61.37 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.508 1.123 . . . . 10.0 112.118 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.2 ttp -100.77 118.05 61.45 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 123.237 0.615 . . . . 10.0 111.826 -172.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.02 154.3 70.92 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.115 1.876 . . . . 10.0 111.926 -173.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -59.58 124.8 16.22 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 123.991 3.127 . . . . 10.0 110.973 -177.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.89 43.03 8.49 Favored Glycine 0 C--N 1.34 0.793 0 CA-C-O 118.954 -0.914 . . . . 10.0 111.249 -172.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 17.6 57.73 0.01 OUTLIER Glycine 0 CA--C 1.531 1.088 0 C-N-CA 126.976 2.227 . . . . 10.0 115.422 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 72.34 -51.98 0.7 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.003 1.321 . . . . 10.0 112.972 -172.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.6 p -79.63 87.57 5.18 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 173.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 68.3 p -55.79 -50.07 71.47 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.399 -0.813 . . . . 10.0 111.124 171.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -78.32 63.24 3.16 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.824 1.65 . . . . 10.0 110.166 178.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 2.9 m -131.12 122.84 27.38 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.863 1.265 . . . . 10.0 111.073 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.0 m -90.83 141.72 28.52 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 124.765 1.226 . . . . 10.0 109.368 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -43.07 -38.18 2.25 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.32 1.23 . . . . 10.0 114.32 177.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -47.81 -58.52 4.25 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.225 1.01 . . . . 10.0 112.417 169.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -74.52 -40.87 61.48 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.901 1.281 . . . . 10.0 110.168 -178.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -57.09 14.08 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.024 0.929 . . . . 10.0 109.811 178.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -51.53 68.28 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.688 1.195 . . . . 10.0 110.036 -177.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.4 -33.76 55.08 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.354 -0.841 . . . . 10.0 112.709 170.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.58 -31.73 47.35 Favored 'General case' 0 C--N 1.341 0.222 0 O-C-N 121.013 -1.055 . . . . 10.0 111.487 -175.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.489 HG12 ' OXT' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -78.81 -50.42 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-O 121.775 0.797 . . . . 10.0 109.471 173.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -53.68 -31.71 48.88 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.203 1.401 . . . . 10.0 112.17 176.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -49.82 -58.08 6.09 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 124.568 1.147 . . . . 10.0 112.197 172.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.431 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 4.9 mpp? -64.17 -57.05 10.68 Favored 'General case' 0 C--N 1.34 0.194 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 177.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -177.09 129.45 0.17 Allowed 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.519 -1.289 . . . . 10.0 107.519 174.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.02 74.16 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.587 1.955 . . . . 10.0 113.185 172.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.519 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -163.99 -65.4 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.484 1.514 . . . . 10.0 113.757 -171.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.489 ' OXT' HG12 ' A' ' 71' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.712 0 N-CA-C 116.006 1.854 . . . . 10.0 116.006 -165.597 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.466 0.329 0 N-CA-C 114.123 1.157 . . . . 10.0 114.123 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -146.97 117.37 7.43 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 -177.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -45.2 -40.58 7.41 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.529 1.131 . . . . 10.0 113.743 173.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -60.48 -49.64 76.74 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.356 -0.215 . . . . 10.0 110.667 172.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.55 -30.69 70.4 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.557 -0.715 . . . . 10.0 111.303 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 15.8 mt -66.73 -52.79 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.437 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.3 OUTLIER -68.56 -40.92 80.43 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 117.921 -1.511 . . . . 10.0 111.16 -179.372 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -69.04 -21.95 64.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.041 1.737 . . . . 10.0 113.273 -178.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.14 -29.08 15.33 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 121.21 -0.931 . . . . 10.0 113.172 168.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.72 -66.72 1.01 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.356 1.062 . . . . 10.0 112.78 -171.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.437 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.04 39.64 0.19 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.116 1.366 . . . . 10.0 110.757 179.169 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -125.12 3.37 7.92 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.797 1.239 . . . . 10.0 113.62 -167.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.3 t -105.84 -52.55 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 124.71 1.204 . . . . 10.0 108.249 -174.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.5 m -84.49 -62.53 1.53 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.559 1.544 . . . . 10.0 111.08 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 72.4 m-70 -73.92 -23.87 59.6 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.943 1.46 . . . . 10.0 114.943 -167.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.42 -46.78 87.76 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.152 0.581 . . . . 10.0 110.456 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -109.51 -22.21 12.1 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.847 0.859 . . . . 10.0 111.871 -176.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.46 57.34 1.88 Allowed Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.032 0.825 . . . . 10.0 112.019 -175.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 46.4 t -103.34 161.24 4.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 125.375 1.47 . . . . 10.0 109.396 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.33 22.05 10.38 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.089 0.956 . . . . 10.0 113.163 -175.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 73.69 16.4 79.17 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 124.157 0.884 . . . . 10.0 113.199 -173.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.15 144.18 98.15 Favored Pre-proline 0 CA--C 1.543 0.699 0 CA-C-N 118.262 1.031 . . . . 10.0 113.366 -174.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -76.28 139.1 20.75 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 124.249 3.299 . . . . 10.0 111.015 -176.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 mttt -62.54 143.81 56.79 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.524 0.564 . . . . 10.0 112.524 -165.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t -49.14 -35.29 16.19 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.436 1.094 . . . . 10.0 113.511 177.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -142.01 57.78 1.48 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.829 0.852 . . . . 10.0 112.277 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -79.35 165.46 23.11 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 165.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.2 p -107.95 -35.91 6.5 Favored 'General case' 0 C--O 1.222 -0.377 0 O-C-N 121.67 -0.643 . . . . 10.0 111.417 164.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.06 -22.01 56.13 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 120.557 -1.34 . . . . 10.0 113.203 -176.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -87.78 -23.4 24.08 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.396 2.278 . . . . 10.0 110.259 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.537 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 43.7 m95 -97.28 -36.8 10.29 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.053 1.741 . . . . 10.0 110.776 178.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -41.64 -59.79 2.26 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.27 1.428 . . . . 10.0 114.037 174.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -64.04 -10.87 24.75 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 122.613 2.209 . . . . 10.0 113.833 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -96.43 -47.77 5.84 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.506 1.122 . . . . 10.0 110.084 176.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -17.58 64.75 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.442 1.897 . . . . 10.0 112.407 179.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -82.36 -38.05 24.77 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 125.026 1.33 . . . . 10.0 109.097 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt -68.01 -49.76 59.61 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.534 171.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 162.59 -132.9 2.91 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 112.142 -0.383 . . . . 10.0 112.142 178.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.3 t -137.86 -54.02 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 C-N-CA 123.875 0.87 . . . . 10.0 109.975 179.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -74.38 34.5 0.09 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.456 1.502 . . . . 10.0 113.251 -177.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.512 ' HB2' HD22 ' A' ' 42' ' ' LEU . 2.4 m-20 -111.08 -54.74 2.57 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.762 2.425 . . . . 10.0 106.27 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.512 HD22 ' HB2' ' A' ' 41' ' ' ASN . 4.0 mm? -77.15 -32.52 56.35 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.481 -0.762 . . . . 10.0 110.552 -175.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.95 -15.3 16.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 O-C-N 121.929 -0.482 . . . . 10.0 111.566 171.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -85.96 -49.11 8.1 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.421 0.688 . . . . 10.0 111.102 168.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.8 m -58.59 -38.87 78.86 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 120.428 1.467 . . . . 10.0 110.64 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.7 p -62.0 -42.94 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-O 121.425 0.631 . . . . 10.0 110.963 -178.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.8 -30.42 51.23 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.762 0.825 . . . . 10.0 111.922 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 53.4 m -74.63 -25.45 59.23 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.438 1.095 . . . . 10.0 112.618 176.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.97 115.16 0.34 Allowed Glycine 0 CA--C 1.529 0.912 0 CA-C-N 119.486 1.039 . . . . 10.0 111.99 -175.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.3 tp -105.77 -145.74 0.38 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.518 0.727 . . . . 10.0 111.008 177.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -80.27 141.66 35.32 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 122.566 1.175 . . . . 10.0 108.768 174.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 55.72 22.09 5.16 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 112.183 -2.281 . . . . 10.0 111.953 173.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.6 ttp -144.64 123.3 6.84 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.516 1.127 . . . . 10.0 110.571 -174.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.45 148.39 48.29 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 121.881 1.721 . . . . 10.0 112.038 -173.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -62.95 113.66 2.1 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 123.648 2.899 . . . . 10.0 110.189 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 114.7 -10.6 21.31 Favored Glycine 0 CA--C 1.529 0.929 0 O-C-N 123.566 0.541 . . . . 10.0 112.668 -170.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.07 49.48 78.03 Favored Glycine 0 CA--C 1.534 1.234 0 O-C-N 120.429 -1.63 . . . . 10.0 109.999 -175.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 76.39 -45.54 0.51 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.462 1.905 . . . . 10.0 112.812 -177.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.0 p -76.86 159.57 29.94 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.215 -0.928 . . . . 10.0 111.279 177.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 34.1 p -110.05 -69.43 0.86 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.315 1.046 . . . . 10.0 110.38 -177.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -78.87 54.68 1.6 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.882 1.273 . . . . 10.0 110.602 -179.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -86.22 115.83 24.03 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.443 1.097 . . . . 10.0 111.086 -176.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 50.0 m -91.69 126.94 36.95 Favored 'General case' 0 C--O 1.231 0.09 0 N-CA-C 108.568 -0.901 . . . . 10.0 108.568 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -43.96 -34.4 1.68 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.299 1.439 . . . . 10.0 113.174 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -43.81 -66.78 0.34 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.464 1.105 . . . . 10.0 113.275 163.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.67 -29.24 62.2 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.329 -0.857 . . . . 10.0 110.081 -177.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.03 -52.62 64.19 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.807 0.813 . . . . 10.0 111.358 179.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -66.69 -47.1 73.49 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-O 117.804 -1.093 . . . . 10.0 109.296 176.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.15 -29.67 5.74 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 120.097 1.317 . . . . 10.0 113.524 171.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.24 -36.61 22.59 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.397 1.079 . . . . 10.0 112.131 -177.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.0 mt -81.63 -47.55 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.86 1.264 . . . . 10.0 111.8 176.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.25 -34.7 33.61 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.336 1.454 . . . . 10.0 112.443 172.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -44.24 -39.71 4.64 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.785 0.834 . . . . 10.0 112.523 173.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.537 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -82.5 -70.43 0.55 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 122.771 0.428 . . . . 10.0 111.962 -178.456 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 t -161.34 32.48 0.14 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.674 0.79 . . . . 10.0 112.488 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.8 pttt 36.94 57.74 1.17 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.457 1.503 . . . . 10.0 114.588 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.05 -52.65 0.37 Allowed 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 113.841 1.052 . . . . 10.0 113.841 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.407 ' O ' ' NZ ' ' A' ' 78' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.911 0 C-N-CA 125.165 1.386 . . . . 10.0 113.443 -166.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.532 0.266 0 N-CA-C 114.165 1.172 . . . . 10.0 114.165 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 3' ' ' ALA . 15.6 t70 -144.47 -153.39 0.47 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.958 1.303 . . . . 10.0 108.321 -174.184 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.407 ' H ' ' CG ' ' A' ' 2' ' ' ASP . . . -127.82 -40.4 1.72 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 128.335 2.654 . . . . 10.0 111.443 177.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -56.49 -46.69 80.35 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.449 0.642 . . . . 10.0 110.47 175.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.96 -31.52 72.15 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.877 -0.514 . . . . 10.0 110.746 -178.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.3 mp -69.3 -52.34 34.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 N-CA-C 107.983 -1.117 . . . . 10.0 107.983 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.485 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -68.27 -39.47 82.15 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 118.181 -1.408 . . . . 10.0 111.325 -179.148 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -69.39 -22.83 63.68 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.204 1.402 . . . . 10.0 113.003 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.64 -30.98 16.04 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.667 0.988 . . . . 10.0 113.667 167.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.01 -64.89 1.21 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.24 1.016 . . . . 10.0 111.946 -166.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.485 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.74 41.2 0.2 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.627 1.171 . . . . 10.0 110.912 177.43 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -128.81 0.25 5.39 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 125.66 1.584 . . . . 10.0 113.631 -166.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.5 t -101.97 -51.11 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 124.62 1.168 . . . . 10.0 108.199 -176.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.6 m -88.67 -64.1 1.2 Allowed 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.119 1.768 . . . . 10.0 109.933 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.3 m-70 -73.65 -11.19 60.34 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.05 1.5 . . . . 10.0 115.05 -166.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.35 -36.68 63.62 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.124 0.97 . . . . 10.0 110.908 178.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -125.23 -37.42 2.4 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.753 1.221 . . . . 10.0 112.24 -172.419 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.35 64.15 1.17 Allowed Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.75 1.643 . . . . 10.0 112.909 175.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 73.5 t -84.67 -56.66 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 123.657 0.783 . . . . 10.0 111.925 -176.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.1 33.23 0.44 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.941 0.897 . . . . 10.0 111.128 177.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 63.59 21.8 65.25 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 124.497 1.046 . . . . 10.0 113.258 -174.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.97 137.95 97.14 Favored Pre-proline 0 CA--C 1.545 0.756 0 O-C-N 121.813 -0.816 . . . . 10.0 112.564 -174.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -70.08 135.55 29.96 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.645 2.897 . . . . 10.0 110.3 -175.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.5 mtmm -53.58 133.62 41.26 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.155 -0.966 . . . . 10.0 112.578 -171.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.4 p -55.68 -14.16 2.07 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.824 1.046 . . . . 10.0 113.824 173.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -145.82 45.65 1.27 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.436 1.094 . . . . 10.0 111.848 177.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.424 ' HB3' ' HB2' ' A' ' 30' ' ' ASP . 1.3 t-20 -76.64 167.95 20.94 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.407 -0.808 . . . . 10.0 109.82 166.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.7 t -109.15 -35.65 6.25 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.875 -0.516 . . . . 10.0 111.53 161.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.83 -21.14 51.94 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.181 -1.574 . . . . 10.0 113.345 -174.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.424 ' HB2' ' HB3' ' A' ' 27' ' ' ASN . 0.5 OUTLIER -82.77 -26.69 31.63 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.08 2.152 . . . . 10.0 110.006 177.063 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.493 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 41.0 m95 -94.5 -36.34 11.9 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.841 1.656 . . . . 10.0 110.846 -177.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -45.33 -56.78 8.66 Favored Pre-proline 0 CA--C 1.545 0.778 0 O-C-N 120.811 -1.181 . . . . 10.0 113.635 174.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -76.47 21.57 0.55 Allowed 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.167 2.578 . . . . 10.0 113.133 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.423 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 1.8 mmp_? -125.37 -47.98 1.71 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.582 1.953 . . . . 10.0 109.02 175.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -19.66 47.14 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.799 2.44 . . . . 10.0 112.036 173.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.41 -28.45 37.81 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 124.526 1.131 . . . . 10.0 110.124 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.6 mmmt -74.93 -51.26 14.23 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 174.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.5 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 158.3 -117.34 0.77 Allowed Glycine 0 CA--C 1.531 1.06 0 C-N-CA 124.686 1.136 . . . . 10.0 110.403 177.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.01 -56.64 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 124.294 1.038 . . . . 10.0 110.764 177.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.49 17.17 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.486 1.115 . . . . 10.0 113.371 -176.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.5 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -97.89 -22.97 16.04 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 125.754 1.621 . . . . 10.0 110.526 177.428 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -104.43 -43.14 5.26 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.338 1.055 . . . . 10.0 110.031 -175.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -54.36 -33.22 25.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 O-C-N 121.72 -0.613 . . . . 10.0 111.151 171.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -63.68 -43.45 96.63 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.217 -0.927 . . . . 10.0 113.112 172.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.7 m -66.16 -34.15 77.4 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.203 -0.935 . . . . 10.0 110.371 177.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.414 ' HA ' ' HE3' ' A' ' 53' ' ' MET . 31.3 t -56.87 -54.86 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 122.491 0.317 . . . . 10.0 110.995 174.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -35.08 68.91 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.952 0.723 . . . . 10.0 112.952 175.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 22.6 m -71.58 -36.13 70.78 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.05 0.54 . . . . 10.0 111.999 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.48 95.68 0.6 Allowed Glycine 0 CA--C 1.528 0.904 0 CA-C-N 118.862 0.756 . . . . 10.0 111.23 -174.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.1 tp -60.13 169.39 1.58 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 122.138 0.971 . . . . 10.0 111.839 173.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.51 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 13.7 m-80 -50.32 -55.95 13.35 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.71 -1.244 . . . . 10.0 112.603 -174.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -95.29 20.39 9.36 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 113.799 -1.546 . . . . 10.0 112.073 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . 0.414 ' HE3' ' HA ' ' A' ' 46' ' ' VAL . 39.7 ttp -129.08 130.63 23.42 Favored Pre-proline 0 CA--C 1.551 1.019 0 N-CA-C 114.478 1.288 . . . . 10.0 114.478 175.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -64.02 157.43 53.1 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 121.992 1.794 . . . . 10.0 112.182 177.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -60.12 137.0 72.66 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.791 2.327 . . . . 10.0 110.118 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 62.16 27.9 69.8 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-O 118.927 -0.93 . . . . 10.0 113.756 -175.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 48.21 33.85 11.63 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.128 1.347 . . . . 10.0 113.782 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 71.15 45.58 0.49 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.973 1.309 . . . . 10.0 112.077 -175.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.8 t -125.5 -52.6 1.6 Allowed 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.592 -0.693 . . . . 10.0 111.669 163.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.9 m 70.2 -69.47 0.17 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.993 1.317 . . . . 10.0 110.818 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -84.16 55.06 3.17 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.878 0.871 . . . . 10.0 110.699 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.3 m -114.65 140.56 48.73 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.354 1.462 . . . . 10.0 109.644 173.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 59.9 m -101.78 146.55 27.62 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.525 1.13 . . . . 10.0 109.492 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -41.92 -39.84 1.97 Allowed 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 115.063 1.505 . . . . 10.0 115.063 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -42.71 -63.59 0.76 Allowed 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.758 1.163 . . . . 10.0 112.607 167.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.82 -40.05 63.62 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.541 1.936 . . . . 10.0 109.613 -175.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -59.12 5.83 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.923 0.889 . . . . 10.0 110.065 178.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt -59.16 -46.29 88.77 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.525 1.13 . . . . 10.0 109.411 178.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.01 -26.48 37.28 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.3 -0.875 . . . . 10.0 112.415 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.85 -6.64 57.2 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 125.212 1.405 . . . . 10.0 112.648 -174.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.51 -40.27 4.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 125.447 1.499 . . . . 10.0 110.335 167.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.81 -40.71 76.47 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.71 0.804 . . . . 10.0 111.108 175.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -52.64 -36.8 57.34 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.893 0.701 . . . . 10.0 112.893 176.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.493 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 2.6 mpp? -75.3 -66.03 0.82 Allowed 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 121.819 -0.55 . . . . 10.0 111.562 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -166.53 35.37 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 119.569 -0.853 . . . . 10.0 112.519 -178.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt 37.29 51.65 1.13 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.861 0.864 . . . . 10.0 113.301 -176.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.423 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -141.3 -82.93 0.21 Allowed 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.012 1.116 . . . . 10.0 114.012 170.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.984 0 N-CA-C 115.733 1.753 . . . . 10.0 115.733 -164.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 . . . . . 0 N--CA 1.461 0.11 0 N-CA-C 113.081 0.771 . . . . 10.0 113.081 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -141.24 127.42 19.65 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.995 -1.113 . . . . 10.0 107.995 172.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.96 -36.99 75.75 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.965 0.906 . . . . 10.0 112.003 175.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -61.94 -48.41 80.53 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 120.401 -0.52 . . . . 10.0 110.934 172.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.08 -31.0 71.61 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 121.34 -0.85 . . . . 10.0 109.848 -177.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 mm -65.77 -52.78 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 117.698 -1.144 . . . . 10.0 109.248 173.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.406 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.5 OUTLIER -68.17 -39.55 82.52 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 121.258 1.844 . . . . 10.0 112.153 -178.541 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -69.74 -22.32 63.38 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.288 2.235 . . . . 10.0 111.926 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.89 -27.12 15.33 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.035 1.124 . . . . 10.0 114.035 166.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -104.98 -70.67 0.77 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.131 1.372 . . . . 10.0 112.557 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.406 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.49 42.07 0.27 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.937 1.695 . . . . 10.0 110.418 -178.775 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.0 t -127.48 -5.49 5.91 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 125.172 1.389 . . . . 10.0 113.677 -164.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 42.1 t -95.87 -53.5 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 CA-C-O 122.311 1.053 . . . . 10.0 108.167 -175.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 29.2 m -93.04 -55.24 3.41 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.525 1.53 . . . . 10.0 109.261 -171.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -72.76 -19.8 61.3 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.677 1.191 . . . . 10.0 113.334 -172.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.9 t -63.62 -49.6 72.67 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.18 0.592 . . . . 10.0 110.879 -178.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.7 tpt -112.08 -27.21 8.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.332 1.053 . . . . 10.0 112.977 -177.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.64 58.62 2.01 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 124.781 1.181 . . . . 10.0 112.859 -177.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 96.2 t -82.63 -58.22 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 121.898 -0.766 . . . . 10.0 112.204 -175.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.55 32.01 0.41 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.873 0.869 . . . . 10.0 111.044 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 63.62 23.91 67.44 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 123.747 0.689 . . . . 10.0 112.832 -172.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.94 145.15 97.71 Favored Pre-proline 0 CA--C 1.544 0.731 0 O-C-N 121.769 -0.842 . . . . 10.0 111.142 176.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.94 144.86 35.01 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.73 2.953 . . . . 10.0 110.873 -174.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -65.53 138.31 57.97 Favored 'General case' 0 C--O 1.239 0.534 0 O-C-N 121.796 -0.565 . . . . 10.0 111.897 -171.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.6 m -19.58 -51.26 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 128.189 2.596 . . . . 10.0 115.206 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -144.68 53.1 1.24 Allowed 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.999 0.428 . . . . 10.0 111.45 173.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -53.34 153.79 3.73 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.348 -0.845 . . . . 10.0 110.105 164.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 94.2 m -100.6 -35.56 9.46 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.203 -0.936 . . . . 10.0 111.001 169.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.09 -23.37 28.53 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 120.966 -1.084 . . . . 10.0 112.595 -171.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -81.71 -32.88 31.43 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.119 1.768 . . . . 10.0 109.768 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 43.6 m95 -85.08 -35.45 21.82 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.313 1.845 . . . . 10.0 111.459 178.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -42.64 -58.77 3.43 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 114.349 1.24 . . . . 10.0 114.349 174.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -73.27 15.58 0.5 Allowed 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 123.209 2.606 . . . . 10.0 113.743 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.03 -49.71 2.5 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.81 1.644 . . . . 10.0 108.95 173.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.9 mt -54.65 -12.01 0.68 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.407 1.483 . . . . 10.0 114.38 170.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.91 -37.16 16.69 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 125.117 1.367 . . . . 10.0 110.019 -173.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.0 mtpt -77.98 -47.07 19.37 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 166.63 -126.2 1.43 Allowed Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.892 -0.883 . . . . 10.0 110.892 173.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 86.5 t -138.62 -64.57 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 C-N-CA 123.399 0.68 . . . . 10.0 110.96 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.13 -35.7 59.99 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 119.065 -0.493 . . . . 10.0 111.373 -174.244 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -33.68 -42.22 0.11 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.742 1.217 . . . . 10.0 112.566 171.124 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -81.37 -42.6 20.25 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.744 1.218 . . . . 10.0 112.524 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -53.52 -33.95 22.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 O-C-N 121.078 -1.014 . . . . 10.0 110.981 169.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -44.31 96.98 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.394 -0.817 . . . . 10.0 112.622 169.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.6 m -61.47 -37.32 83.19 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 120.598 -1.314 . . . . 10.0 110.249 174.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 7.0 t -63.6 -55.1 24.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 122.866 0.466 . . . . 10.0 111.592 -178.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.03 -32.62 64.19 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 176.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.3 m -72.23 -30.0 64.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.936 0.895 . . . . 10.0 112.077 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 74.97 94.64 0.14 Allowed Glycine 0 CA--C 1.53 0.983 0 CA-C-N 118.98 0.809 . . . . 10.0 111.903 -176.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.2 tp -65.0 170.5 4.32 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.93 -0.747 . . . . 10.0 111.696 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.478 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 5.5 m-80 -48.84 -58.19 5.21 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.612 -1.305 . . . . 10.0 112.946 -170.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.03 24.92 5.14 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.15 1.38 . . . . 10.0 112.768 173.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 35.3 ttp -132.01 127.19 21.0 Favored Pre-proline 0 CA--C 1.554 1.097 0 N-CA-C 114.5 1.296 . . . . 10.0 114.5 172.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.09 157.34 53.89 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 122.035 1.823 . . . . 10.0 112.937 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -64.78 129.92 24.74 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 123.663 2.908 . . . . 10.0 110.593 -175.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.02 25.46 74.67 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 121.575 -0.345 . . . . 10.0 112.429 -170.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.16 -46.3 2.7 Favored Glycine 0 CA--C 1.534 1.24 0 O-C-N 121.369 -1.077 . . . . 10.0 114.178 170.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -174.13 -48.27 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.387 2.275 . . . . 10.0 109.997 171.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.8 t -79.56 131.49 36.03 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.724 1.61 . . . . 10.0 110.9 177.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.5 m -89.54 -50.0 6.35 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 122.027 0.917 . . . . 10.0 110.212 173.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -78.88 60.6 2.9 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.725 2.41 . . . . 10.0 110.064 179.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 21.4 m -134.3 148.32 50.75 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.98 1.712 . . . . 10.0 110.615 174.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 59.4 m -108.93 155.78 20.45 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.639 1.576 . . . . 10.0 109.859 -178.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -46.17 -40.66 11.51 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.438 1.095 . . . . 10.0 112.99 177.326 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -57.12 -47.47 81.02 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.611 -0.68 . . . . 10.0 111.868 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.32 -44.07 63.22 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.812 -0.811 . . . . 10.0 108.812 -179.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -55.71 -49.95 71.63 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.266 0.555 . . . . 10.0 111.955 176.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -67.75 -52.55 36.07 Favored 'General case' 0 C--O 1.218 -0.603 0 CA-C-O 118.071 -0.966 . . . . 10.0 108.777 -176.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.39 -39.3 15.01 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.736 1.153 . . . . 10.0 112.859 171.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.05 -50.26 50.11 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.387 -0.821 . . . . 10.0 110.825 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 51.2 mt -58.31 -37.74 65.04 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.026 0 C-N-CA 125.498 1.519 . . . . 10.0 112.212 172.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -68.41 -38.22 81.05 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 126.778 2.031 . . . . 10.0 111.596 175.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -52.03 -36.18 49.35 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.538 0.57 . . . . 10.0 112.538 172.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 66.1 mtm -80.45 -71.97 0.43 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.777 0.831 . . . . 10.0 112.633 -179.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 7.0 t -162.96 45.59 0.13 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.742 -0.599 . . . . 10.0 111.78 172.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.2 ptpt 36.11 57.98 0.99 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.048 1.739 . . . . 10.0 114.948 176.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.21 -80.01 0.04 OUTLIER 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 112.425 0.528 . . . . 10.0 112.425 171.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.254 1.312 0 N-CA-C 116.005 1.854 . . . . 10.0 116.005 -169.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.534 0.338 0 N-CA-C 111.95 0.352 . . . . 10.0 111.95 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -143.85 125.22 14.72 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.775 1.23 . . . . 10.0 108.217 172.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -49.54 -39.24 33.84 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.36 1.064 . . . . 10.0 112.558 170.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -59.97 -45.06 93.92 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 122.365 -0.209 . . . . 10.0 111.175 171.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.6 -34.25 76.63 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.366 -0.834 . . . . 10.0 110.667 -179.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 35.6 mt -64.37 -52.75 51.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 N-CA-C 108.432 -0.951 . . . . 10.0 108.432 178.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.45 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.65 -39.83 76.85 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 117.962 -1.495 . . . . 10.0 111.998 -178.147 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -68.46 -22.6 64.56 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.118 1.367 . . . . 10.0 112.45 -177.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.65 -28.73 15.82 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.444 0.905 . . . . 10.0 113.444 170.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.03 -67.7 0.96 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.854 0.862 . . . . 10.0 112.373 -171.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.45 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.78 45.07 0.4 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 125.119 1.368 . . . . 10.0 110.159 -178.574 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.9 t -125.91 -15.13 5.98 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 120.495 -1.378 . . . . 10.0 113.859 -162.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.427 HG23 ' SG ' ' A' ' 14' ' ' CYS . 0.9 OUTLIER -95.02 -30.36 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.596 1.158 . . . . 10.0 109.1 -175.328 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.427 ' SG ' HG23 ' A' ' 13' ' ' VAL . 96.1 m -107.4 -64.12 1.23 Allowed 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 128.254 2.622 . . . . 10.0 109.624 -173.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -74.8 -19.38 60.22 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.929 1.085 . . . . 10.0 113.929 -168.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.8 t -61.88 -50.67 71.27 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.502 0.721 . . . . 10.0 110.891 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.6 mmt -109.15 -13.96 14.58 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.311 1.444 . . . . 10.0 112.731 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.91 45.6 7.59 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.43 1.014 . . . . 10.0 112.087 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 91.9 t -90.52 159.88 2.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 124.855 1.262 . . . . 10.0 109.512 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.11 19.0 5.66 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.677 1.191 . . . . 10.0 113.754 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.62 7.38 75.46 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.555 1.074 . . . . 10.0 113.804 -175.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.53 147.87 96.83 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 118.403 1.101 . . . . 10.0 113.234 -172.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -68.46 164.09 34.1 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 123.677 2.918 . . . . 10.0 110.351 174.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -84.76 142.68 29.64 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.523 -0.736 . . . . 10.0 111.919 -176.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -45.84 -28.06 1.0 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.449 1.5 . . . . 10.0 113.837 172.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -135.31 125.01 25.28 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.867 0.867 . . . . 10.0 109.282 164.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -155.03 157.86 38.25 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.374 1.87 . . . . 10.0 106.496 172.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 75.7 m -108.39 -36.41 6.25 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.728 0.695 . . . . 10.0 111.464 171.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.28 -29.55 53.87 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.379 -0.825 . . . . 10.0 112.205 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -75.98 -34.58 59.77 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.392 1.477 . . . . 10.0 110.177 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.459 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 58.9 m95 -84.7 -34.06 23.02 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.752 2.021 . . . . 10.0 112.024 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -39.01 -61.73 0.89 Allowed Pre-proline 0 CA--C 1.546 0.797 0 N-CA-C 114.719 1.377 . . . . 10.0 114.719 173.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.32 -16.62 52.49 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.766 2.311 . . . . 10.0 113.265 -177.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.4 mmt180 -87.5 -51.68 5.78 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.886 1.274 . . . . 10.0 109.269 -179.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.36 -17.53 30.72 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.509 1.524 . . . . 10.0 113.413 174.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.16 -38.6 12.05 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 125.479 1.511 . . . . 10.0 109.97 -173.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -62.25 -51.67 66.79 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.145 -0.48 . . . . 10.0 109.806 167.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.409 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 160.7 -129.85 2.24 Favored Glycine 0 CA--C 1.533 1.174 0 N-CA-C 111.092 -0.803 . . . . 10.0 111.092 176.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 5.2 t -134.05 -58.03 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 123.848 0.859 . . . . 10.0 109.663 179.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.87 19.09 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.891 1.676 . . . . 10.0 114.63 -175.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.409 HD21 ' N ' ' A' ' 38' ' ' GLY . 1.2 m-20 -97.4 -26.22 14.94 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 127.591 2.356 . . . . 10.0 110.189 174.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -94.58 -47.48 6.51 Favored 'General case' 0 N--CA 1.445 -0.675 0 C-N-CA 123.694 0.797 . . . . 10.0 109.736 -175.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.512 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.6 OUTLIER -51.93 -32.92 15.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.657 1.183 . . . . 10.0 112.29 173.041 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -71.38 -37.56 71.57 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 120.427 -1.42 . . . . 10.0 112.838 172.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.474 ' HA ' HG22 ' A' ' 48' ' ' THR . 2.6 t -75.87 -36.06 59.67 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.582 1.553 . . . . 10.0 110.996 -175.111 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.512 HG12 ' HA ' ' A' ' 43' ' ' VAL . 8.8 p -65.92 -48.27 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 O-C-N 121.408 -0.807 . . . . 10.0 110.852 168.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -34.51 76.13 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.954 -0.698 . . . . 10.0 111.266 -176.049 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.474 HG22 ' HA ' ' A' ' 45' ' ' SER . 1.2 t -74.95 -32.61 61.78 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.798 -0.564 . . . . 10.0 112.018 174.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.5 112.1 1.0 Allowed Glycine 0 CA--C 1.532 1.144 0 C-N-CA 123.904 0.764 . . . . 10.0 112.684 -173.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.61 -175.51 4.39 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.68 0.792 . . . . 10.0 110.835 169.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -55.02 -64.44 0.83 Allowed 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.308 -1.495 . . . . 10.0 113.706 -162.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.52 8.1 6.98 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 115.598 -0.728 . . . . 10.0 112.5 173.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.19 138.91 19.68 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 114.113 1.153 . . . . 10.0 114.113 -175.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.38 140.42 52.76 Favored 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.094 1.862 . . . . 10.0 110.966 174.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -65.05 102.43 0.44 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.458 2.772 . . . . 10.0 109.649 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 110.35 12.37 17.54 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.342 0.496 . . . . 10.0 113.435 -175.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 56.15 34.75 62.91 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 118.663 1.232 . . . . 10.0 111.876 -177.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 73.59 -7.08 1.64 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.202 2.201 . . . . 10.0 114.074 -177.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.4 t -106.03 114.3 28.36 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.889 0.768 . . . . 10.0 112.113 -173.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 32.4 p -72.48 -53.4 12.22 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.321 1.048 . . . . 10.0 110.892 175.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -101.31 77.18 1.77 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.699 2.0 . . . . 10.0 109.024 177.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 12.0 m -123.87 132.63 53.79 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 121.572 -0.705 . . . . 10.0 110.844 161.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.8 p -79.25 163.27 25.09 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 122.159 -0.338 . . . . 10.0 110.198 171.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.98 -40.48 73.34 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.635 -0.666 . . . . 10.0 112.546 168.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.26 -51.83 63.31 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.728 0.695 . . . . 10.0 110.585 175.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -72.62 -36.6 68.11 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 122.23 -0.294 . . . . 10.0 111.34 -177.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -61.32 -52.17 65.81 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.749 -1.219 . . . . 10.0 111.334 173.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -63.37 -46.88 84.47 Favored 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 123.922 0.889 . . . . 10.0 109.823 -177.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.24 -40.86 49.01 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 121.323 0.582 . . . . 10.0 112.221 168.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.5 -39.82 70.57 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.865 -1.147 . . . . 10.0 112.051 -178.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.59 -55.49 19.58 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 124.078 0.951 . . . . 10.0 111.295 171.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -23.07 65.92 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 120.906 -1.121 . . . . 10.0 113.65 -177.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -43.69 -48.12 7.84 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.066 0.848 . . . . 10.0 111.364 168.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.459 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 3.6 mpp? -72.05 -50.02 31.86 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 112.228 0.455 . . . . 10.0 112.228 -179.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.84 -75.37 0.15 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.996 -0.526 . . . . 10.0 112.071 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 155.6 50.95 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 129.582 3.153 . . . . 10.0 111.589 -177.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -164.26 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.344 1.239 . . . . 10.0 114.344 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.27 0 N-CA-C 114.855 1.428 . . . . 10.0 114.855 -176.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 . . . . . 0 CA--C 1.538 0.499 0 N-CA-C 115.906 1.817 . . . . 10.0 115.906 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.444 ' O ' HD13 ' A' ' 6' ' ' ILE . 14.5 t70 -147.53 -160.4 1.16 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.563 1.545 . . . . 10.0 107.664 -174.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -117.51 -40.2 3.08 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 128.609 2.764 . . . . 10.0 111.469 177.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.21 -46.85 82.53 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.239 0.542 . . . . 10.0 110.203 174.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.9 -29.33 69.19 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.72 -0.613 . . . . 10.0 110.91 -175.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.444 HD13 ' O ' ' A' ' 2' ' ' ASP . 1.1 mp -67.92 -53.0 33.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 108.236 -1.024 . . . . 10.0 108.236 177.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.434 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.6 OUTLIER -68.44 -40.52 81.11 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 117.309 -1.756 . . . . 10.0 111.359 -178.762 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -69.61 -22.62 63.48 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.62 1.568 . . . . 10.0 113.164 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -96.38 -28.7 14.34 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.679 0.992 . . . . 10.0 113.679 170.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.47 -64.27 1.27 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.571 0.748 . . . . 10.0 112.011 -168.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.434 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.1 OUTLIER -73.92 29.13 0.08 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.591 1.157 . . . . 10.0 111.837 177.737 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -110.23 5.2 21.63 Favored 'General case' 0 CA--C 1.522 -0.124 0 O-C-N 120.583 -1.323 . . . . 10.0 113.984 -163.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 23.9 t -107.08 -44.4 7.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 125.048 1.339 . . . . 10.0 108.976 -172.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.7 m -95.85 -63.43 1.15 Allowed 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.92 2.088 . . . . 10.0 111.313 -177.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 35.9 m-70 -73.82 -23.26 59.63 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.606 0.965 . . . . 10.0 113.606 -167.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.1 t -58.47 -45.97 87.58 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.566 1.146 . . . . 10.0 111.041 -178.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 25.9 mmt -111.78 -20.55 12.03 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.983 1.313 . . . . 10.0 112.68 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.87 48.32 3.67 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 123.823 0.725 . . . . 10.0 112.16 -176.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 74.4 t -92.94 161.54 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 C-N-CA 125.107 1.363 . . . . 10.0 109.26 177.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.64 20.04 5.97 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.589 1.156 . . . . 10.0 113.328 -174.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 71.95 26.37 72.72 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.219 0.914 . . . . 10.0 113.293 -173.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.69 144.19 76.48 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 113.926 1.084 . . . . 10.0 113.926 -176.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -80.24 124.06 5.25 Favored 'Trans proline' 0 CA--C 1.537 0.646 1 C-N-CA 125.475 4.117 . . . . 10.0 111.759 -174.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -57.39 141.85 45.79 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 125.115 1.366 . . . . 10.0 112.485 -160.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.7 m -49.86 -56.94 8.52 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.532 0.568 . . . . 10.0 112.532 175.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -108.48 94.43 5.06 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 122.147 0.975 . . . . 10.0 111.098 178.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -135.72 166.5 23.13 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.226 1.41 . . . . 10.0 108.136 176.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.4 m -107.25 -38.59 5.93 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 118.259 0.482 . . . . 10.0 111.164 169.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.4 -16.15 47.02 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 120.868 -1.145 . . . . 10.0 113.22 -174.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -89.12 -23.49 22.47 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.199 1.8 . . . . 10.0 110.395 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 81.1 m95 -96.62 -36.0 10.87 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 126.443 1.897 . . . . 10.0 111.631 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -42.16 -58.64 3.28 Favored Pre-proline 0 CA--C 1.549 0.915 0 N-CA-C 114.436 1.272 . . . . 10.0 114.436 172.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.14 15.54 0.75 Allowed 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.517 2.812 . . . . 10.0 113.397 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.4 mmt85 -116.62 -45.42 2.8 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.555 1.542 . . . . 10.0 108.599 176.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.51 3.91 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.738 2.015 . . . . 10.0 114.916 165.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.02 -30.07 21.49 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.55 1.14 . . . . 10.0 110.289 177.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? -88.66 -56.04 3.46 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.902 0.481 . . . . 10.0 110.056 174.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.63 -122.33 1.11 Allowed Glycine 0 CA--C 1.531 1.089 0 C-N-CA 124.492 1.044 . . . . 10.0 110.526 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.5 -58.48 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 C-N-CA 124.181 0.992 . . . . 10.0 110.929 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.73 35.54 0.13 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.604 1.562 . . . . 10.0 113.369 -170.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -113.04 -57.65 2.26 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 128.017 2.527 . . . . 10.0 107.514 179.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mt -67.23 -29.5 69.16 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.916 1.286 . . . . 10.0 110.263 -175.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -55.69 -17.61 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 126.04 1.736 . . . . 10.0 113.743 168.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.9 mtmt -93.23 -43.38 8.85 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 172.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.457 ' HA ' HG22 ' A' ' 48' ' ' THR . 4.4 m -61.8 -32.3 72.58 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.121 0.962 . . . . 10.0 109.749 177.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.5 p -69.9 -38.52 75.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 170.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.4 -32.77 68.8 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.344 -0.848 . . . . 10.0 112.443 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.457 HG22 ' HA ' ' A' ' 45' ' ' SER . 10.1 t -75.47 -36.64 60.61 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.819 0.848 . . . . 10.0 113.211 173.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 82.77 117.66 0.56 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.607 -0.597 . . . . 10.0 111.607 -167.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.29 -150.87 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.268 0.627 . . . . 10.0 110.062 164.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -75.95 -67.23 0.7 Allowed 'General case' 0 N--CA 1.476 0.834 0 O-C-N 119.482 -2.011 . . . . 10.0 112.156 -172.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.68 -12.35 59.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.899 1.279 . . . . 10.0 111.919 174.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 mmm -78.24 129.31 75.62 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.151 0.58 . . . . 10.0 111.497 172.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.28 145.45 59.99 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 121.685 1.59 . . . . 10.0 110.071 176.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -61.59 130.06 30.2 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.656 2.237 . . . . 10.0 109.736 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.76 26.7 66.57 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 119.397 -1.382 . . . . 10.0 112.051 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 40.91 34.99 0.86 Allowed Glycine 0 CA--C 1.534 1.264 0 C-N-CA 126.123 1.821 . . . . 10.0 115.903 177.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.72 38.21 18.46 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.758 1.223 . . . . 10.0 112.868 -175.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -126.84 147.91 50.01 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.702 2.001 . . . . 10.0 109.666 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.7 m -116.15 -77.93 0.57 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.341 0.657 . . . . 10.0 110.245 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -79.1 46.3 0.69 Allowed 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.55 1.14 . . . . 10.0 111.055 -173.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 4.5 m -125.52 138.69 53.98 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.171 1.788 . . . . 10.0 110.918 -166.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 45.8 m -112.17 -103.33 0.4 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.979 0.809 . . . . 10.0 109.948 -171.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -139.74 -48.42 0.46 Allowed 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 124.568 1.147 . . . . 10.0 109.011 -178.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -43.84 -60.27 1.89 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 120.325 1.421 . . . . 10.0 113.854 175.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 50.2 m-20 -74.32 -29.93 61.83 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.596 0.712 . . . . 10.0 110.217 -178.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -44.85 95.67 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.226 -0.921 . . . . 10.0 113.058 177.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -62.35 -56.34 19.28 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 124.547 1.139 . . . . 10.0 108.373 174.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.42 -33.34 30.07 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.76 -47.25 75.86 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.242 -0.911 . . . . 10.0 111.829 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -57.01 -47.83 82.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.702 0.801 . . . . 10.0 111.119 170.048 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -64.38 -36.39 83.98 Favored 'General case' 0 C--O 1.228 -0.074 0 O-C-N 121.243 -0.911 . . . . 10.0 113.192 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -49.57 -49.69 45.36 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.728 0.695 . . . . 10.0 111.088 176.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 75.8 mtm -66.45 -45.16 80.74 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.996 0.518 . . . . 10.0 112.39 -179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.56 -71.79 0.09 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 118.774 -0.632 . . . . 10.0 112.566 172.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt 152.21 57.87 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 130.073 3.349 . . . . 10.0 112.106 -178.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -170.56 -75.52 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 114.505 1.298 . . . . 10.0 114.505 170.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.3 pttp . . . . . 0 C--O 1.254 1.303 0 C-N-CA 125.666 1.586 . . . . 10.0 114.626 -172.571 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 . . . . . 0 N--CA 1.464 0.271 0 N-CA-C 112.31 0.485 . . . . 10.0 112.31 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -149.43 112.93 5.0 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.64 0.776 . . . . 10.0 110.027 178.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -32.17 -46.65 0.13 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.816 2.046 . . . . 10.0 115.158 162.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.0 tt0 -58.66 -48.58 80.58 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 118.833 0.742 . . . . 10.0 110.724 173.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.46 -33.98 76.23 Favored 'General case' 0 C--O 1.226 -0.159 0 O-C-N 121.893 -0.504 . . . . 10.0 110.327 -177.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.7 mm -65.83 -51.0 66.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-O 118.459 -0.781 . . . . 10.0 109.212 176.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.482 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -67.8 -40.41 83.89 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 117.686 -1.605 . . . . 10.0 111.445 -179.656 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -68.88 -23.38 64.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.389 1.476 . . . . 10.0 112.957 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -27.85 15.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.985 1.314 . . . . 10.0 112.831 171.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.71 -65.81 1.15 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.76 1.224 . . . . 10.0 113.456 -172.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.482 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.94 45.58 0.35 Allowed 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 124.159 0.984 . . . . 10.0 110.148 179.731 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.0 t -129.22 -15.14 4.21 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 120.459 -1.401 . . . . 10.0 113.856 -162.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 19.6 m -97.59 -42.83 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 C-N-CA 124.185 0.994 . . . . 10.0 109.552 -177.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.7 m -85.8 -64.34 1.17 Allowed 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 126.831 2.052 . . . . 10.0 110.262 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -73.49 -26.1 60.74 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.637 0.977 . . . . 10.0 113.637 -165.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.0 t -56.06 -49.27 74.24 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.896 0.878 . . . . 10.0 111.136 -178.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.0 mmt -112.88 -9.21 13.66 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.726 0.81 . . . . 10.0 112.445 -178.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.61 42.88 8.12 Favored Glycine 0 CA--C 1.533 1.197 0 O-C-N 121.575 -0.703 . . . . 10.0 111.896 -179.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 50.1 t -88.89 161.27 2.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 125.081 1.352 . . . . 10.0 109.12 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.7 18.16 4.59 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.42 1.088 . . . . 10.0 113.933 -175.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 84.54 11.55 77.35 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.69 1.138 . . . . 10.0 113.787 -176.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.08 152.09 94.78 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-N 118.702 1.251 . . . . 10.0 113.757 -174.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -76.75 138.42 18.92 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.12 2.546 . . . . 10.0 110.83 -176.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.62 127.38 22.73 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.226 1.01 . . . . 10.0 113.008 -173.356 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 91.0 p 0.84 -82.39 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 128.15 2.58 . . . . 10.0 115.349 171.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.6 p80 -144.66 110.95 5.55 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 122.073 0.939 . . . . 10.0 110.051 170.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -128.45 -178.37 4.54 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.589 1.556 . . . . 10.0 110.235 174.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.9 t -99.35 -32.79 10.99 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.333 0.515 . . . . 10.0 112.11 169.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.42 -53.48 57.07 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.585 -1.322 . . . . 10.0 114.306 -171.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -79.74 -21.86 43.98 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.622 0.725 . . . . 10.0 110.837 -178.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.442 ' HE3' ' HB3' ' A' ' 77' ' ' ALA . 71.9 m95 -79.64 -29.28 40.95 Favored 'General case' 0 CA--C 1.554 1.114 0 O-C-N 121.348 -0.845 . . . . 10.0 112.259 174.511 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -47.12 -61.41 2.85 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.641 1.576 . . . . 10.0 114.955 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -62.91 -16.39 53.61 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.186 1.924 . . . . 10.0 112.914 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.6 mmt85 -82.92 -46.43 12.97 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.766 1.226 . . . . 10.0 108.34 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.606 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -63.11 -17.9 62.83 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.381 1.872 . . . . 10.0 112.518 172.888 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.18 -33.15 26.26 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.452 1.101 . . . . 10.0 109.666 177.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -74.84 -51.62 13.5 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 122.236 0.215 . . . . 10.0 111.075 171.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.426 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 156.21 -104.52 0.25 Allowed Glycine 0 CA--C 1.531 1.082 0 C-N-CA 123.088 0.375 . . . . 10.0 112.626 170.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.54 -61.62 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 123.98 0.912 . . . . 10.0 110.439 175.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.408 ' HA ' HG12 ' A' ' 43' ' ' VAL . 0.9 OUTLIER -76.71 36.44 0.16 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.333 1.453 . . . . 10.0 113.096 -170.94 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.426 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -111.99 -54.1 2.64 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.786 -1.931 . . . . 10.0 105.786 -176.632 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -79.56 -33.71 41.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.201 1.0 . . . . 10.0 111.618 -177.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.408 HG12 ' HA ' ' A' ' 40' ' ' ASP . 0.5 OUTLIER -64.02 -11.21 9.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.65 -0.656 . . . . 10.0 111.8 170.756 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.6 mmpt? -78.78 -45.3 21.3 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.017 -1.052 . . . . 10.0 111.383 163.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 33.9 m -63.9 -38.27 90.45 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 120.294 -1.504 . . . . 10.0 110.766 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -56.57 -39.45 62.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 121.424 0.631 . . . . 10.0 111.968 177.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HA ' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -77.39 -29.66 53.25 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.003 0.521 . . . . 10.0 111.776 -179.811 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 99.2 m -73.11 -32.12 64.74 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.447 0.699 . . . . 10.0 112.623 175.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.12 111.54 0.92 Allowed Glycine 0 C--N 1.34 0.778 0 N-CA-C 110.327 -1.109 . . . . 10.0 110.327 -170.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.44 -163.18 0.09 Allowed 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.685 1.194 . . . . 10.0 109.278 162.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -74.12 -67.42 0.61 Allowed 'General case' 0 N--CA 1.476 0.826 0 O-C-N 119.888 -1.758 . . . . 10.0 112.492 -170.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.38 -33.9 77.04 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.217 1.007 . . . . 10.0 111.166 173.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -73.03 128.96 87.07 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 126.4 1.88 . . . . 10.0 112.086 -172.166 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.16 144.23 68.18 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 121.632 1.555 . . . . 10.0 110.135 177.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -61.27 126.38 19.23 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.551 2.167 . . . . 10.0 109.439 175.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.436 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 93.06 25.53 19.31 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 120.987 -0.625 . . . . 10.0 112.939 179.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.83 35.11 4.23 Favored Glycine 0 CA--C 1.543 1.837 0 CA-C-N 118.002 0.901 . . . . 10.0 114.507 -177.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 14.3 ttm 70.13 -4.04 1.64 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.247 2.219 . . . . 10.0 114.926 -176.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.51 -38.88 6.61 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.064 -1.023 . . . . 10.0 112.511 -179.096 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 72.9 m 67.38 -60.65 0.37 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.517 1.927 . . . . 10.0 112.86 -176.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -79.64 57.05 2.37 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.724 1.21 . . . . 10.0 110.351 -177.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -112.15 123.0 49.31 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.154 1.382 . . . . 10.0 110.655 -171.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.4 t -93.57 133.31 37.01 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 173.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -32.37 -41.73 0.06 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.893 2.077 . . . . 10.0 113.326 171.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -40.61 -61.29 0.96 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.692 1.197 . . . . 10.0 113.7 170.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.12 -28.3 24.09 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.674 0.67 . . . . 10.0 111.383 178.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -43.7 78.31 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.948 -1.095 . . . . 10.0 111.244 176.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.7 ptmm? -72.49 -45.16 60.77 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.513 1.125 . . . . 10.0 109.698 178.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.504 ' HA ' ' HG2' ' A' ' 72' ' ' GLU . . . -50.25 -38.03 38.72 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 121.798 0.809 . . . . 10.0 111.889 173.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.29 -41.78 76.34 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.912 0.885 . . . . 10.0 111.851 -176.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 27.3 pt -76.24 -42.28 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 O-C-N 121.751 -0.593 . . . . 10.0 111.761 175.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . 0.504 ' HG2' ' HA ' ' A' ' 69' ' ' ALA 0.258 5.7 pt-20 -64.67 -25.09 67.8 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.659 -0.651 . . . . 10.0 111.905 177.827 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -49.33 -44.43 44.48 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.587 0.63 . . . . 10.0 112.112 164.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 70.0 mtm -82.0 -57.26 3.49 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.464 0.705 . . . . 10.0 110.332 178.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.1 t -177.65 121.21 0.11 Allowed 'General case' 0 C--O 1.223 -0.31 0 C-N-CA 126.822 2.049 . . . . 10.0 108.207 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.57 83.1 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.001 -1.062 . . . . 10.0 112.984 178.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.606 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -157.76 -69.58 0.09 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 114.055 1.131 . . . . 10.0 114.055 -178.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.429 ' HG2' ' CZ3' ' A' ' 31' ' ' TRP . 4.7 ptpp? . . . . . 0 C--O 1.249 1.072 0 C-N-CA 124.198 0.999 . . . . 10.0 112.103 -177.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.562 0 N-CA-C 113.134 0.79 . . . . 10.0 113.134 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -138.18 -172.46 3.28 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.35 2.26 . . . . 10.0 106.399 179.213 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.434 ' HB1' ' HA ' ' A' ' 70' ' ' ALA . . . -89.56 -45.65 9.23 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.653 2.381 . . . . 10.0 111.562 174.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -55.02 -50.09 69.9 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-O 121.931 0.872 . . . . 10.0 110.43 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.82 -31.44 69.33 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.464 -177.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -66.72 -52.06 49.45 Favored 'Isoleucine or valine' 0 C--N 1.34 0.18 0 N-CA-C 108.273 -1.01 . . . . 10.0 108.273 176.081 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -41.49 75.99 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 119.461 1.028 . . . . 10.0 110.328 -174.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -69.14 -23.97 64.03 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.464 1.106 . . . . 10.0 112.254 -178.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.7 ttpp -86.16 -30.48 22.45 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.18 -0.95 . . . . 10.0 113.423 166.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.38 -69.5 0.86 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.226 1.011 . . . . 10.0 112.84 -164.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.39 31.9 0.09 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.876 1.67 . . . . 10.0 111.234 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.9 t -111.38 8.71 21.38 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 124.624 1.17 . . . . 10.0 113.268 -164.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.7 t -111.42 -45.88 5.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.772 1.229 . . . . 10.0 108.902 -173.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.7 m -92.44 -64.24 1.13 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.946 1.699 . . . . 10.0 111.423 176.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -73.08 -25.65 60.97 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.425 0.69 . . . . 10.0 112.426 -166.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.03 -53.43 55.93 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.648 1.179 . . . . 10.0 111.014 -179.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.6 ttt -105.43 -21.03 13.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.283 1.033 . . . . 10.0 112.047 -178.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.95 53.48 2.37 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.111 0.862 . . . . 10.0 112.095 -175.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.8 t -95.05 162.66 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 125.131 1.372 . . . . 10.0 109.299 177.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 60.01 16.37 5.8 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.657 1.183 . . . . 10.0 113.976 -177.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.5 22.12 79.13 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 123.524 0.583 . . . . 10.0 113.028 -171.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.95 157.07 77.84 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 124.104 0.962 . . . . 10.0 112.07 177.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -72.79 165.27 33.23 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 122.577 2.185 . . . . 10.0 110.606 -178.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.9 tptt -77.37 126.42 30.88 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.652 -175.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.7 t -34.02 -42.69 0.13 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.391 2.276 . . . . 10.0 114.573 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.0 p-80 -138.59 133.51 32.6 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 108.459 -0.941 . . . . 10.0 108.459 157.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -148.59 168.43 22.79 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 125.565 1.546 . . . . 10.0 108.75 170.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.3 t -104.75 -36.83 7.29 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 120.567 -0.453 . . . . 10.0 111.438 164.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.57 -23.47 42.73 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 119.959 -1.713 . . . . 10.0 114.025 -174.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -82.68 -34.58 27.32 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.092 1.357 . . . . 10.0 109.33 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.45 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 45.9 m95 -85.82 -34.44 21.08 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 125.899 1.68 . . . . 10.0 111.907 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -43.63 -57.27 5.91 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 125.227 1.411 . . . . 10.0 114.43 174.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -65.25 -5.67 11.63 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.648 2.232 . . . . 10.0 113.898 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.442 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 8.8 mmt180 -103.05 -46.99 4.48 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.863 1.265 . . . . 10.0 110.369 179.038 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.2 mt -55.06 -4.3 0.07 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.883 1.673 . . . . 10.0 114.405 166.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.67 -33.31 17.62 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.087 1.355 . . . . 10.0 110.193 -176.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.53 -54.36 6.23 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 171.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.471 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 166.58 -132.89 2.75 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 110.916 -0.874 . . . . 10.0 110.916 -177.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 62.5 t -140.39 -56.92 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 124.181 0.992 . . . . 10.0 110.476 -173.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.42 ' HA ' HG12 ' A' ' 43' ' ' VAL . 62.2 m-20 -69.88 11.19 0.31 Allowed 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 113.701 1.0 . . . . 10.0 113.701 -176.695 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.471 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -92.68 -21.67 19.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 127.516 2.327 . . . . 10.0 111.143 -179.69 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.4 -32.16 8.25 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.522 0.729 . . . . 10.0 110.874 -177.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' A' ' 40' ' ' ASP . 1.8 p -60.31 -23.79 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 125.68 1.592 . . . . 10.0 111.281 169.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.53 -44.66 57.08 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 121.363 -0.835 . . . . 10.0 111.875 167.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.598 ' HA ' HG22 ' A' ' 48' ' ' THR . 0.4 OUTLIER -76.05 -23.87 55.12 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 120.989 -1.069 . . . . 10.0 111.901 -174.319 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.426 HG13 ' CZ ' ' A' ' 67' ' ' TYR . 1.7 p -68.95 -40.64 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 O-C-N 121.027 -1.045 . . . . 10.0 111.129 172.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.64 -31.0 66.38 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.149 0.5 . . . . 10.0 111.372 -178.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . 0.598 HG22 ' HA ' ' A' ' 45' ' ' SER . 1.5 t -89.43 -22.39 22.54 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.0 1.32 . . . . 10.0 112.495 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.05 117.56 0.82 Allowed Glycine 0 CA--C 1.535 1.307 0 N-CA-C 111.355 -0.698 . . . . 10.0 111.355 -170.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 tp -74.42 -152.48 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.992 0 O-C-N 122.031 -0.687 . . . . 10.0 110.393 169.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -65.27 -63.9 0.99 Allowed 'General case' 0 N--CA 1.471 0.618 0 O-C-N 119.753 -1.842 . . . . 10.0 111.592 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -101.39 44.19 1.02 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 113.282 -1.781 . . . . 10.0 109.084 -175.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -143.12 134.76 12.91 Favored Pre-proline 0 CA--C 1.536 0.42 0 C-N-CA 124.58 1.152 . . . . 10.0 111.606 -177.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.42 156.41 45.65 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 121.866 1.711 . . . . 10.0 110.211 176.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.67 120.52 7.64 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 122.759 2.306 . . . . 10.0 110.165 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.6 34.97 6.35 Favored Glycine 0 CA--C 1.531 1.087 0 O-C-N 122.091 -0.381 . . . . 10.0 113.242 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 57.18 -84.27 0.01 OUTLIER Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.556 1.074 . . . . 10.0 114.345 172.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -175.0 38.93 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.986 2.114 . . . . 10.0 112.376 165.322 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.45 147.77 49.08 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.751 1.221 . . . . 10.0 111.153 -175.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.8 t -71.42 -50.13 34.93 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -173.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -123.81 76.13 1.41 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.229 1.412 . . . . 10.0 108.473 175.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 8.3 m -71.87 91.1 1.15 Allowed 'General case' 0 CA--C 1.538 0.5 0 O-C-N 120.889 -1.132 . . . . 10.0 111.19 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -78.51 149.39 33.14 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 121.151 -0.968 . . . . 10.0 108.495 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.79 -37.32 76.07 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 120.315 1.416 . . . . 10.0 112.084 172.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.2 pt-20 -51.49 -46.6 63.22 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 119.065 -0.493 . . . . 10.0 111.608 174.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 -82.85 -39.43 21.64 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.829 0.74 . . . . 10.0 112.624 176.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CZ ' HG13 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -55.99 -46.22 78.78 Favored 'General case' 0 N--CA 1.463 0.22 0 O-C-N 120.5 -1.375 . . . . 10.0 111.543 -178.226 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -68.5 -45.79 71.39 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 -177.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.66 -38.97 61.37 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 121.633 0.73 . . . . 10.0 112.647 169.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.434 ' HA ' ' HB1' ' A' ' 3' ' ' ALA . . . -80.05 -39.55 29.56 Favored 'General case' 0 C--O 1.225 -0.226 0 O-C-N 120.602 -1.311 . . . . 10.0 113.592 -174.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.0 mt -70.38 -38.18 73.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 O-C-N 121.831 -0.543 . . . . 10.0 110.466 171.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . 0.299 0.0 OUTLIER -69.59 -31.71 70.02 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 114.195 1.183 . . . . 10.0 114.195 176.629 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -42.02 -47.14 4.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.628 1.171 . . . . 10.0 112.17 173.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.45 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.2 mpp? -81.65 -73.14 0.4 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.505 0.558 . . . . 10.0 112.505 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.2 33.87 0.17 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.155 0.582 . . . . 10.0 112.063 178.59 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.269 16.0 ptpt 42.62 46.81 4.4 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.892 1.677 . . . . 10.0 114.137 -179.297 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.442 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -150.97 -92.71 0.06 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.965 1.469 . . . . 10.0 114.965 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 7.4 pttt . . . . . 0 C--O 1.253 1.25 0 N-CA-C 116.071 1.878 . . . . 10.0 116.071 -175.666 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.533 0.327 0 N-CA-C 113.817 1.043 . . . . 10.0 113.817 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -139.69 -137.44 0.12 Allowed 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.365 1.066 . . . . 10.0 110.366 -172.162 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -147.94 -49.45 0.17 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 130.344 3.457 . . . . 10.0 109.302 -174.61 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -54.26 -50.51 67.07 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 121.247 0.546 . . . . 10.0 110.301 171.103 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 -29.75 68.69 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 121.777 -0.577 . . . . 10.0 111.415 -176.363 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.5 mp -68.8 -52.67 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.932 -1.136 . . . . 10.0 107.932 178.004 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.425 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -68.23 -41.25 81.53 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 118.225 -1.39 . . . . 10.0 110.918 -179.612 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -68.51 -22.95 64.5 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.132 1.373 . . . . 10.0 112.546 -176.779 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.72 -29.74 16.66 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.37 1.248 . . . . 10.0 114.37 166.298 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.27 -66.19 1.09 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.104 0.865 . . . . 10.0 112.363 -167.121 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.425 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.2 42.84 0.27 Allowed 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 124.126 0.971 . . . . 10.0 109.883 177.604 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.7 t -122.56 -6.88 8.64 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 120.477 -1.389 . . . . 10.0 114.03 -164.056 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.8 m -105.88 -41.97 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 123.59 0.756 . . . . 10.0 109.352 -178.219 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 m -86.88 -63.91 1.23 Allowed 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.657 1.583 . . . . 10.0 110.136 177.992 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -74.1 -28.23 61.26 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.277 1.214 . . . . 10.0 114.277 -167.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.1 t -59.58 -51.36 70.15 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.565 0.746 . . . . 10.0 111.408 -179.049 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 28.9 mmt -101.76 -19.49 15.33 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.434 0.694 . . . . 10.0 111.844 -179.531 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.18 49.59 4.17 Favored Glycine 0 CA--C 1.532 1.143 0 O-C-N 121.428 -0.795 . . . . 10.0 111.986 -178.222 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 66.6 t -99.29 162.95 2.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 126.127 1.771 . . . . 10.0 109.313 -177.816 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.68 19.66 8.34 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.411 1.084 . . . . 10.0 113.367 -176.237 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 81.23 10.29 84.94 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 124.522 1.058 . . . . 10.0 113.142 -174.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.96 144.49 95.77 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-N 118.422 1.111 . . . . 10.0 112.767 -176.863 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.446 ' CG ' ' HE3' ' A' ' 78' ' ' LYS . 42.6 Cg_endo -81.14 151.77 18.25 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 124.784 3.656 . . . . 10.0 110.392 179.349 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.2 mptt -103.25 143.2 32.96 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.211 -166.308 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.3 p -77.05 55.23 1.11 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.207 1.003 . . . . 10.0 112.46 175.131 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -146.96 -45.59 0.18 Allowed 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 114.072 1.138 . . . . 10.0 114.072 175.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -71.25 149.2 46.45 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 108.369 -0.974 . . . . 10.0 108.369 -177.925 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 9.5 t -95.46 -30.5 13.83 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 118.652 0.66 . . . . 10.0 110.139 178.111 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.42 -29.08 69.72 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 114.65 1.352 . . . . 10.0 114.65 -178.234 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -76.42 -31.39 57.88 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 122.34 1.067 . . . . 10.0 111.075 176.832 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 73.4 m95 -89.47 -32.02 17.41 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.32 1.448 . . . . 10.0 112.355 -177.038 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -49.18 -57.45 11.57 Favored Pre-proline 0 CA--C 1.542 0.667 0 O-C-N 120.461 -1.4 . . . . 10.0 114.609 175.509 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -65.72 -1.33 4.8 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 122.609 2.206 . . . . 10.0 113.209 178.617 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.5 mmt85 -101.14 -55.16 2.62 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.987 1.315 . . . . 10.0 108.513 176.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.519 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 1.0 OUTLIER -60.07 -13.73 13.15 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.725 1.61 . . . . 10.0 114.472 175.827 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -86.11 -38.84 17.34 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 124.363 1.065 . . . . 10.0 109.422 -174.135 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.49 -45.56 37.63 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.549 -0.75 . . . . 10.0 110.932 174.594 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 161.92 -136.32 4.32 Favored Glycine 0 CA--C 1.533 1.158 0 N-CA-C 110.822 -0.911 . . . . 10.0 110.822 -178.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 67.0 t -139.61 -57.53 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 122.524 1.154 . . . . 10.0 111.048 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -43.33 -36.78 1.99 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.281 1.832 . . . . 10.0 112.988 170.949 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -47.21 -27.32 1.45 Allowed 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.822 1.045 . . . . 10.0 113.822 173.883 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -100.45 -38.48 8.39 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 125.206 1.402 . . . . 10.0 111.471 179.535 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -53.26 -36.81 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 CA-C-N 118.912 0.778 . . . . 10.0 110.285 170.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.9 ptmt -63.72 -44.24 94.17 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.145 1.165 . . . . 10.0 114.145 171.446 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.7 m -64.46 -33.96 77.1 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 120.91 -1.119 . . . . 10.0 110.241 178.669 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.6 t -62.42 -55.0 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 123.736 0.814 . . . . 10.0 112.072 176.328 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.82 -36.97 65.56 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.762 0.315 . . . . 10.0 111.617 177.28 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 21.7 m -71.13 -34.67 71.26 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.945 0.898 . . . . 10.0 111.79 -177.802 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 75.4 112.32 0.1 Allowed Glycine 0 C--N 1.339 0.701 0 N-CA-C 110.596 -1.002 . . . . 10.0 110.596 -167.951 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.0 tp -68.9 -170.48 0.23 Allowed 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 121.501 0.667 . . . . 10.0 109.708 167.232 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -68.09 -61.01 2.05 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 119.559 -1.963 . . . . 10.0 112.023 -167.323 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.97 -40.85 83.07 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.789 1.236 . . . . 10.0 112.041 172.154 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.8 ttt -74.45 120.85 83.47 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 126.572 1.949 . . . . 10.0 112.594 -174.005 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -63.5 156.9 53.92 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.264 1.976 . . . . 10.0 111.712 -177.558 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -57.87 141.85 96.09 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 123.296 2.664 . . . . 10.0 110.475 178.143 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.23 22.01 72.42 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 120.177 -1.011 . . . . 10.0 113.451 -175.992 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.96 29.48 4.53 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 124.435 1.017 . . . . 10.0 114.462 -176.422 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.9 ttt 75.01 23.87 1.59 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.115 1.766 . . . . 10.0 114.382 -178.057 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.5 t -95.26 155.9 16.54 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 121.107 -0.995 . . . . 10.0 113.228 -179.086 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 41.4 m -69.75 -82.22 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.125 0.97 . . . . 10.0 112.552 178.627 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -125.49 43.12 3.13 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.421 1.088 . . . . 10.0 110.61 -176.711 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.27 126.96 29.74 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.224 -0.922 . . . . 10.0 111.658 -179.174 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.5 m -97.66 -83.49 0.4 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.544 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -156.08 -53.75 0.08 Allowed 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 127.278 2.231 . . . . 10.0 110.162 179.9 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -51.93 -42.53 62.87 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.08 0.552 . . . . 10.0 111.413 178.018 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -47.43 45.84 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 106.977 -1.49 . . . . 10.0 106.977 -178.045 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.24 -52.7 63.68 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.789 1.636 . . . . 10.0 111.798 -173.545 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -66.92 -42.31 85.58 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 125.055 1.342 . . . . 10.0 109.083 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.6 -35.46 63.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.448 1.022 . . . . 10.0 112.772 170.746 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.9 -47.01 49.49 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 120.293 -1.504 . . . . 10.0 111.099 177.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.1 mt -63.61 -37.61 80.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.982 1.313 . . . . 10.0 112.309 177.148 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -71.42 -30.33 65.94 Favored 'General case' 0 C--O 1.231 0.088 0 C-N-CA 124.606 1.162 . . . . 10.0 111.152 176.411 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -53.44 -30.09 38.76 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 112.927 0.714 . . . . 10.0 112.927 171.288 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 71.0 mtm -90.09 -72.72 0.55 Allowed 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.628 -0.67 . . . . 10.0 112.629 178.692 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.49 37.73 0.24 Allowed 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.765 -0.584 . . . . 10.0 112.497 176.24 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.7 ptmt 40.66 56.5 2.79 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 126.057 1.743 . . . . 10.0 114.665 172.489 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.519 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -159.72 -78.35 0.06 Allowed 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 124.371 1.068 . . . . 10.0 111.357 170.211 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.446 ' HE3' ' CG ' ' A' ' 23' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.242 0.666 0 N-CA-C 113.003 0.742 . . . . 10.0 113.003 -176.602 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 . . . . . 0 CA--C 1.53 0.181 0 N-CA-C 114.848 1.425 . . . . 10.0 114.848 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -156.52 120.49 4.37 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.613 0.721 . . . . 10.0 109.605 179.85 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -43.97 -39.14 3.87 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 114.741 1.386 . . . . 10.0 114.741 170.158 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -56.62 -47.95 78.53 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 121.874 -0.516 . . . . 10.0 110.51 172.365 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.23 -33.09 73.76 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.837 -0.539 . . . . 10.0 110.87 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 12.8 mm -65.17 -52.07 57.62 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 176.147 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.57 -41.78 79.23 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 118.144 -1.422 . . . . 10.0 111.438 -178.244 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -68.79 -22.64 64.26 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.08 1.352 . . . . 10.0 112.473 -176.756 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -94.42 -28.41 15.52 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.081 1.141 . . . . 10.0 114.081 168.676 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.23 -63.84 1.25 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.14 0.976 . . . . 10.0 113.005 -171.749 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.4 35.6 0.15 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.198 1.399 . . . . 10.0 111.04 -178.303 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.4 t -124.94 -1.57 7.81 Favored 'General case' 0 N--CA 1.46 0.054 0 C-N-CA 124.97 1.308 . . . . 10.0 113.779 -163.74 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.2 t -104.56 -47.83 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 124.783 1.233 . . . . 10.0 108.957 -173.016 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.5 m -84.33 -65.53 1.0 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.186 1.395 . . . . 10.0 110.717 172.05 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -74.4 -20.81 59.92 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.169 1.544 . . . . 10.0 115.169 -163.004 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m -64.73 -44.64 89.5 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 118.392 0.542 . . . . 10.0 110.979 176.845 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.8 mmt -102.17 -22.88 14.11 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.819 1.247 . . . . 10.0 111.899 -177.057 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.13 41.7 6.96 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.094 0.854 . . . . 10.0 111.931 -175.169 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 84.7 t -87.6 159.81 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 124.459 1.104 . . . . 10.0 109.417 179.076 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.63 16.17 5.21 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.938 1.295 . . . . 10.0 113.571 -174.342 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.92 16.18 80.24 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.212 0.91 . . . . 10.0 113.361 -172.803 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.78 132.79 94.0 Favored Pre-proline 0 CA--C 1.544 0.721 0 CA-C-N 118.649 1.224 . . . . 10.0 113.339 -174.55 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.11 140.85 61.25 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.788 2.992 . . . . 10.0 111.206 -178.589 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.36 145.21 55.97 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.809 0.814 . . . . 10.0 112.353 -166.712 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.9 p -51.34 -37.64 48.91 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.39 1.076 . . . . 10.0 113.275 176.455 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -122.19 40.88 3.54 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.398 1.258 . . . . 10.0 114.398 -174.598 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -85.03 165.35 17.61 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.425 -0.797 . . . . 10.0 112.099 174.103 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.2 t -104.34 -34.94 8.13 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.427 0.291 . . . . 10.0 111.415 165.663 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.43 -33.64 60.94 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 120.787 -1.195 . . . . 10.0 113.035 -174.689 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -73.15 -28.9 62.5 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.105 0.479 . . . . 10.0 110.366 179.305 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 69.7 m95 -91.67 -35.46 14.18 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.764 2.026 . . . . 10.0 110.938 -174.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -40.28 -63.17 0.76 Allowed Pre-proline 0 CA--C 1.547 0.832 0 N-CA-C 115.038 1.496 . . . . 10.0 115.038 174.173 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -66.19 -6.12 13.98 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.867 2.378 . . . . 10.0 113.497 -178.664 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.519 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 5.5 mmt85 -98.98 -45.63 5.89 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.977 1.711 . . . . 10.0 108.994 -177.916 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -24.39 63.51 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.818 2.047 . . . . 10.0 110.702 177.556 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.47 -28.53 52.36 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.366 1.066 . . . . 10.0 109.747 176.378 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt -77.38 -52.5 9.04 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.5 0.32 . . . . 10.0 110.519 172.654 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.465 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 164.63 -106.8 0.28 Allowed Glycine 0 CA--C 1.531 1.061 0 C-N-CA 123.558 0.599 . . . . 10.0 111.75 172.823 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -153.83 -61.58 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 C-N-CA 123.971 0.908 . . . . 10.0 109.413 177.405 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.482 ' HA ' HG12 ' A' ' 43' ' ' VAL . 1.3 m-20 -72.6 24.52 0.06 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.035 1.334 . . . . 10.0 113.242 -171.53 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.465 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -106.57 -25.64 11.73 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 127.705 2.402 . . . . 10.0 108.822 -176.767 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.409 HD22 ' HB2' ' A' ' 41' ' ' ASN . 3.5 mm? -99.52 -42.48 6.91 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.892 1.277 . . . . 10.0 110.85 178.948 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.482 HG12 ' HA ' ' A' ' 40' ' ' ASP . 2.7 p -53.25 -35.74 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 122.884 0.474 . . . . 10.0 111.069 171.985 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 ptmt -59.93 -43.6 94.85 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.717 -1.239 . . . . 10.0 112.419 171.767 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.7 m -72.46 -33.78 67.27 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.692 -0.63 . . . . 10.0 110.72 -176.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -47.57 85.62 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 O-C-N 122.067 -0.396 . . . . 10.0 111.197 172.617 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -30.8 71.11 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.788 0.328 . . . . 10.0 111.725 177.005 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.89 -35.95 64.72 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.535 0.939 . . . . 10.0 113.535 179.386 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.47 109.25 0.53 Allowed Glycine 0 CA--C 1.529 0.947 0 N-CA-C 111.254 -0.738 . . . . 10.0 111.254 -167.175 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.71 -154.79 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.139 0.975 . . . . 10.0 109.147 168.959 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -73.04 -66.53 0.66 Allowed 'General case' 0 N--CA 1.479 0.978 0 O-C-N 119.231 -2.168 . . . . 10.0 111.557 -174.875 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.35 -21.48 61.3 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.329 1.052 . . . . 10.0 111.801 174.396 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.4 mtm -84.87 125.2 71.44 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 112.525 0.565 . . . . 10.0 112.525 -179.668 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.51 150.09 69.27 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.063 1.842 . . . . 10.0 111.194 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -60.8 115.07 2.44 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 123.342 2.695 . . . . 10.0 109.817 179.669 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 95.5 10.78 56.56 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 121.309 -0.472 . . . . 10.0 113.559 -175.479 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.98 53.49 7.42 Favored Glycine 0 CA--C 1.536 1.391 0 CA-C-N 118.508 1.154 . . . . 10.0 113.233 175.156 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 83.02 -41.02 0.1 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 127.012 2.125 . . . . 10.0 112.588 -176.797 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.0 t -78.88 176.46 9.57 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.677 -0.64 . . . . 10.0 110.857 174.437 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.0 p -125.17 -73.59 0.63 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.912 1.285 . . . . 10.0 108.282 167.644 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -79.02 58.99 2.56 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.632 1.973 . . . . 10.0 110.439 -179.112 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 25.6 m -109.4 143.82 38.44 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.196 0.998 . . . . 10.0 112.729 169.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 98.8 m -125.83 151.09 47.28 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 125.389 1.476 . . . . 10.0 109.922 -178.781 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -39.59 -38.41 0.6 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.7 2.0 . . . . 10.0 114.82 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -35.33 -53.24 0.64 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.867 1.267 . . . . 10.0 114.349 168.362 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -99.63 -26.51 14.06 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.515 1.526 . . . . 10.0 113.274 171.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -50.38 40.9 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.391 -1.443 . . . . 10.0 110.665 -176.187 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.9 tttt -67.58 -50.71 57.04 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 123.794 0.838 . . . . 10.0 108.909 179.606 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.11 -26.08 2.51 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.512 0.93 . . . . 10.0 113.512 173.413 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.69 -39.38 20.24 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.893 1.277 . . . . 10.0 110.676 -179.839 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . 0.403 HG23 ' O ' ' A' ' 78' ' ' LYS . 3.5 mt -72.85 -45.99 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 125.456 1.502 . . . . 10.0 111.789 177.651 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.84 -26.61 67.74 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.434 1.094 . . . . 10.0 112.73 177.229 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -53.43 -28.54 30.57 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.399 0.889 . . . . 10.0 113.399 169.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 62.7 mtm -87.59 -78.05 0.32 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.69 0.796 . . . . 10.0 112.104 179.676 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.4 t -153.37 37.61 0.48 Allowed 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.823 -0.548 . . . . 10.0 111.588 176.255 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt 32.78 66.14 0.21 Allowed 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.532 1.933 . . . . 10.0 114.915 174.669 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.519 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -160.09 -53.86 0.06 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.419 0.896 . . . . 10.0 113.419 -176.959 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.403 ' O ' HG23 ' A' ' 71' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.604 0 C-N-CA 126.15 1.78 . . . . 10.0 111.344 -179.704 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 . . . . . 0 CA--C 1.534 0.337 0 N-CA-C 113.625 0.972 . . . . 10.0 113.625 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -142.98 128.78 19.37 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.112 -1.07 . . . . 10.0 108.112 171.754 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -52.87 -38.31 61.45 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.44 1.096 . . . . 10.0 112.983 172.128 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -56.61 -48.7 76.9 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.781 0.324 . . . . 10.0 110.275 170.206 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.91 -32.22 70.42 Favored 'General case' 0 CA--C 1.528 0.103 0 O-C-N 121.696 -0.627 . . . . 10.0 111.72 -177.611 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.434 ' CD1' ' HB3' ' A' ' 66' ' ' ASP . 36.0 mt -64.76 -52.96 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 N-CA-C 107.328 -1.36 . . . . 10.0 107.328 176.252 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.473 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -69.38 -42.52 75.06 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 117.934 -1.506 . . . . 10.0 111.457 -176.298 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -70.49 -24.03 62.78 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.689 1.595 . . . . 10.0 113.148 -176.618 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.14 -31.29 19.24 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.12 0.873 . . . . 10.0 111.984 167.604 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -102.4 -68.23 0.84 Allowed 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 114.094 1.146 . . . . 10.0 114.094 -171.773 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.473 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.82 41.12 0.34 Allowed 'General case' 0 CA--C 1.554 1.107 0 CA-C-O 123.176 1.465 . . . . 10.0 109.238 -174.922 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.0 t -123.99 -10.23 7.67 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 126.34 1.856 . . . . 10.0 112.701 -164.644 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 49.2 t -92.97 -51.62 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 C-N-CA 125.401 1.48 . . . . 10.0 108.102 -177.215 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.7 m -95.14 -57.12 2.51 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.701 1.601 . . . . 10.0 109.816 -171.771 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -73.15 -23.98 60.53 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.001 0.92 . . . . 10.0 112.914 -169.789 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.7 t -62.46 -40.43 96.61 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.799 0.809 . . . . 10.0 111.332 -173.802 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.3 tpt -118.77 -32.49 4.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.564 1.545 . . . . 10.0 112.337 -178.198 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.82 58.9 1.55 Allowed Glycine 0 CA--C 1.534 1.252 0 C-N-CA 124.704 1.145 . . . . 10.0 113.343 -176.687 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 96.0 t -82.35 -57.44 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 O-C-N 121.637 -0.92 . . . . 10.0 112.625 -176.581 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.05 31.22 0.38 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.035 0.934 . . . . 10.0 111.113 179.78 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 62.28 25.78 67.03 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 123.763 0.696 . . . . 10.0 112.552 -169.781 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.78 148.22 96.47 Favored Pre-proline 0 CA--C 1.54 0.578 0 O-C-N 122.015 -0.697 . . . . 10.0 111.467 177.079 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -77.62 142.4 20.51 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 123.287 2.658 . . . . 10.0 111.709 -171.15 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.39 130.18 30.58 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.347 1.24 . . . . 10.0 114.347 -172.295 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.0 m -17.33 -74.04 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 128.922 2.889 . . . . 10.0 115.627 -177.843 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -146.16 115.18 6.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 169.499 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -143.79 -175.74 4.7 Favored 'General case' 0 N--CA 1.443 -0.79 0 C-N-CA 124.325 1.05 . . . . 10.0 110.182 176.532 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 t -102.96 -30.0 11.06 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 170.014 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.47 -52.56 64.69 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 119.892 -1.755 . . . . 10.0 114.452 -173.98 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.429 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 9.5 t0 -77.8 -22.07 50.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.319 1.848 . . . . 10.0 110.049 -179.777 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.4 ' CE3' ' HB2' ' A' ' 75' ' ' SER . 54.3 m95 -86.74 -25.44 24.7 Favored 'General case' 0 CA--C 1.553 1.088 0 O-C-N 121.134 -0.979 . . . . 10.0 112.485 177.83 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -49.47 -56.91 13.75 Favored Pre-proline 0 CA--C 1.54 0.586 0 O-C-N 120.543 -1.348 . . . . 10.0 113.096 174.874 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -69.7 9.75 0.55 Allowed 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 122.457 2.104 . . . . 10.0 113.612 178.322 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -110.31 -49.97 3.01 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.477 1.511 . . . . 10.0 108.687 173.784 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 16.8 mt -63.43 9.01 0.06 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.51 1.924 . . . . 10.0 114.65 171.043 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -95.93 -29.16 14.32 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.406 1.482 . . . . 10.0 110.6 175.813 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.9 mmtt -92.47 -54.13 3.92 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.143 0.977 . . . . 10.0 109.968 179.844 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.435 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 166.72 -139.69 5.89 Favored Glycine 0 CA--C 1.533 1.167 0 N-CA-C 110.725 -0.95 . . . . 10.0 110.725 -178.543 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 60.5 t -132.75 -63.15 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.418 1.087 . . . . 10.0 109.545 -175.504 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.66 10.15 0.11 Allowed 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 125.98 1.712 . . . . 10.0 114.025 -176.447 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.435 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -90.63 -19.55 23.54 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 128.455 2.702 . . . . 10.0 111.48 176.743 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mt -106.48 -41.19 5.35 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.627 1.171 . . . . 10.0 109.028 -171.381 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.5 p -51.53 -37.0 18.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 C-N-CA 123.049 0.54 . . . . 10.0 111.556 168.227 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.3 ptmt -62.79 -39.22 93.56 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.022 -1.049 . . . . 10.0 113.285 171.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.9 m -70.3 -37.65 74.84 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 121.039 -1.038 . . . . 10.0 110.656 -179.67 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 14.2 t -52.88 -53.63 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 124.043 0.937 . . . . 10.0 110.395 172.209 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HA ' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -59.16 -35.75 74.09 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.774 0.657 . . . . 10.0 112.774 176.629 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 63.2 m -72.19 -33.3 67.55 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 118.9 -0.571 . . . . 10.0 112.319 -179.378 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.86 85.1 0.5 Allowed Glycine 0 CA--C 1.533 1.17 0 CA-C-N 119.413 1.006 . . . . 10.0 111.215 -174.019 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.44 172.38 0.34 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.655 1.182 . . . . 10.0 111.523 170.307 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -46.85 -57.79 4.57 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.802 -1.186 . . . . 10.0 112.992 -170.767 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -102.13 28.26 5.97 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 113.647 -1.615 . . . . 10.0 110.585 -179.644 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.3 mmm -123.07 129.2 25.05 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.912 1.285 . . . . 10.0 112.484 179.553 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -68.87 157.34 62.23 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.739 2.293 . . . . 10.0 110.825 176.098 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -61.85 132.81 41.52 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.508 2.139 . . . . 10.0 109.31 -178.679 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.412 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 53.45 41.12 63.0 Favored Glycine 0 C--N 1.338 0.673 0 C-N-CA 121.504 -0.379 . . . . 10.0 112.929 -178.185 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.47 50.58 10.34 Favored Glycine 0 CA--C 1.532 1.121 0 N-CA-C 112.062 -0.415 . . . . 10.0 112.062 -179.514 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 65.05 36.72 7.19 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.762 1.625 . . . . 10.0 112.808 176.592 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.5 t -126.18 148.74 49.37 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.293 1.037 . . . . 10.0 111.543 175.319 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 25.4 m -81.54 -75.03 0.3 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.259 0.623 . . . . 10.0 111.048 179.407 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -114.27 41.8 2.21 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.879 1.272 . . . . 10.0 111.631 -175.348 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 7.1 m -61.43 136.57 58.08 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.152 -0.968 . . . . 10.0 110.833 171.248 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 28.6 m -107.13 159.04 16.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.985 1.714 . . . . 10.0 108.881 175.775 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -44.26 -43.7 7.49 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.219 1.192 . . . . 10.0 114.219 175.865 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -51.56 -38.03 52.43 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.084 0.401 . . . . 10.0 112.084 176.595 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.434 ' HB3' ' CD1' ' A' ' 6' ' ' ILE . 0.3 OUTLIER -85.41 -48.15 9.28 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.922 0.889 . . . . 10.0 111.131 177.039 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.11 -52.44 65.73 Favored 'General case' 0 C--N 1.34 0.157 0 O-C-N 121.338 -0.851 . . . . 10.0 111.572 -175.725 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -61.13 -53.16 60.51 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 -179.563 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.29 -37.12 10.19 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.238 0.829 . . . . 10.0 113.238 170.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.34 -43.22 77.96 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.095 -1.003 . . . . 10.0 112.373 179.901 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 21.8 pt -76.23 -35.34 27.72 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 O-C-N 121.34 -0.85 . . . . 10.0 112.729 177.254 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -67.92 -29.31 68.36 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.535 1.534 . . . . 10.0 111.843 171.56 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -54.35 -50.54 67.2 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.95 -1.093 . . . . 10.0 110.861 169.696 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 70.1 mtm -65.77 -65.09 0.72 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.595 0.358 . . . . 10.0 110.071 178.047 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.4 ' HB2' ' CE3' ' A' ' 31' ' ' TRP . 3.8 m -141.66 -87.4 0.16 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.055 -0.35 . . . . 10.0 110.055 175.507 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt 174.34 49.27 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.131 1.772 . . . . 10.0 110.855 -176.598 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -168.4 -83.97 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.563 1.319 . . . . 10.0 114.563 179.58 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.429 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.151 0 N-CA-C 114.457 1.28 . . . . 10.0 114.457 -170.639 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.536 0.426 0 N-CA-C 115.137 1.532 . . . . 10.0 115.137 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -161.81 167.91 24.04 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.498 1.519 . . . . 10.0 107.27 -173.553 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.38 -49.02 13.02 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.645 2.378 . . . . 10.0 112.183 172.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -58.3 -45.92 87.07 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-O 121.126 0.488 . . . . 10.0 110.599 -179.398 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.29 -34.38 77.85 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.04 -0.412 . . . . 10.0 109.962 -176.68 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.473 HD12 ' SG ' ' A' ' 62' ' ' CYS . 4.8 mm -66.45 -50.56 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 118.388 -0.815 . . . . 10.0 110.779 177.009 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.1 -39.26 86.7 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 117.011 -1.876 . . . . 10.0 111.048 179.29 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -69.17 -22.45 63.91 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.482 1.513 . . . . 10.0 113.099 -178.107 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.61 -29.13 16.3 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.138 0.975 . . . . 10.0 113.175 170.758 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.22 -64.63 1.27 Allowed 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.136 0.974 . . . . 10.0 112.667 -169.286 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.01 42.05 0.24 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.893 1.277 . . . . 10.0 110.896 177.834 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.2 t -126.65 -2.5 6.69 Favored 'General case' 0 CA--C 1.521 -0.146 0 C-N-CA 124.948 1.299 . . . . 10.0 114.067 -163.968 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.8 t -102.78 -52.52 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 124.019 0.928 . . . . 10.0 108.861 -174.256 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.3 m -81.14 -64.91 1.09 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.728 1.611 . . . . 10.0 110.471 175.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 28.8 m-70 -73.65 -13.03 60.93 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.01 1.324 . . . . 10.0 114.534 -163.936 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 t -73.51 -38.92 65.18 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.161 0.584 . . . . 10.0 110.658 -179.101 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.8 tpt -117.87 -34.32 4.22 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.899 1.279 . . . . 10.0 113.001 -177.039 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.9 52.62 2.06 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.687 1.613 . . . . 10.0 113.414 178.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 84.4 t -75.02 -56.15 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 O-C-N 121.702 -0.881 . . . . 10.0 112.585 -174.452 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.91 33.72 0.44 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.74 0.816 . . . . 10.0 111.038 -179.299 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 65.04 21.35 67.81 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 124.406 1.003 . . . . 10.0 112.606 -170.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.65 140.59 97.5 Favored Pre-proline 0 CA--C 1.546 0.806 0 N-CA-C 113.426 0.899 . . . . 10.0 113.426 -172.559 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -71.56 143.4 42.38 Favored 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 125.217 3.945 . . . . 10.0 111.038 -177.255 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -67.19 145.14 55.54 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.258 -0.901 . . . . 10.0 113.43 -166.136 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 79.0 p -41.03 -40.09 1.36 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.714 1.206 . . . . 10.0 113.442 161.499 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -133.06 122.84 24.73 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.939 1.296 . . . . 10.0 110.511 171.706 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -154.69 170.46 21.5 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.867 2.067 . . . . 10.0 107.727 172.58 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.3 m -110.61 -37.99 5.3 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.644 0.656 . . . . 10.0 111.93 169.366 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.83 -19.72 37.03 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 120.996 -1.065 . . . . 10.0 112.836 -175.946 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -79.1 -35.51 42.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.455 1.902 . . . . 10.0 110.133 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.495 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 70.5 m95 -88.48 -37.87 15.44 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.802 2.441 . . . . 10.0 112.736 -179.695 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -40.01 -59.96 1.6 Allowed Pre-proline 0 CA--C 1.545 0.773 0 N-CA-C 113.983 1.105 . . . . 10.0 113.983 173.696 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.65 22.13 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.073 3.182 . . . . 10.0 114.731 178.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.624 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -125.98 -47.27 1.65 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.288 1.835 . . . . 10.0 109.854 167.7 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.46 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 1.5 mt -54.81 -5.45 0.09 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.316 1.846 . . . . 10.0 114.154 168.142 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.35 -31.41 48.56 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.194 1.398 . . . . 10.0 109.792 178.245 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.3 mttp -91.31 -57.18 2.87 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.79 0.436 . . . . 10.0 110.515 169.531 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.66 -114.52 0.66 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.255 -0.738 . . . . 10.0 111.255 172.643 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -127.04 175.74 8.45 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.085 0 C-N-CA 125.529 1.531 . . . . 10.0 110.612 176.904 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.9 t70 73.45 -42.15 0.51 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.37 1.468 . . . . 10.0 112.138 -174.381 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -20.22 8.34 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.262 -0.899 . . . . 10.0 113.192 -176.353 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -103.51 -40.65 6.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.676 1.59 . . . . 10.0 111.572 178.988 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.513 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.4 OUTLIER -48.27 -35.52 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 124.622 1.169 . . . . 10.0 111.819 167.449 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -66.81 -43.48 83.69 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 120.528 -1.358 . . . . 10.0 114.065 169.115 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.5 m -72.34 -34.12 67.8 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.643 -1.286 . . . . 10.0 111.522 -176.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.513 HG12 ' HA ' ' A' ' 43' ' ' VAL . 9.9 p -68.03 -47.16 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 O-C-N 121.612 -0.68 . . . . 10.0 110.967 174.268 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -56.07 -41.97 75.93 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.112 0.414 . . . . 10.0 110.822 -179.904 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 32.7 p -72.86 -35.1 67.14 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.115 0.783 . . . . 10.0 113.115 178.491 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.15 105.59 0.85 Allowed Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.868 0.758 . . . . 10.0 112.562 -174.743 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.87 170.38 4.32 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.151 0.981 . . . . 10.0 111.621 171.053 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.5 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 5.2 m-80 -52.04 -60.36 3.28 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.583 -1.323 . . . . 10.0 113.419 -169.268 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.51 15.85 1.92 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.692 1.197 . . . . 10.0 112.635 174.167 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.9 ttp -125.39 129.72 24.35 Favored Pre-proline 0 CA--C 1.547 0.84 0 N-CA-C 113.834 1.05 . . . . 10.0 113.834 -175.128 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.16 156.75 53.42 Favored 'Trans proline' 0 CA--C 1.538 0.721 0 C-N-CA 121.492 1.461 . . . . 10.0 111.636 178.758 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -57.48 139.26 89.61 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 122.408 2.072 . . . . 10.0 109.143 177.835 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.32 23.23 59.8 Favored Glycine 0 CA--C 1.528 0.858 0 C-N-CA 121.162 -0.542 . . . . 10.0 114.025 -174.378 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 49.66 37.27 26.83 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.278 1.039 . . . . 10.0 111.266 -174.272 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER 91.55 -27.13 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.487 2.315 . . . . 10.0 112.871 -176.478 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 19.3 t -95.46 69.82 3.07 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.087 -1.008 . . . . 10.0 113.048 -176.864 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.4 m -53.82 -22.06 8.82 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.263 -0.898 . . . . 10.0 113.03 170.322 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -78.57 -24.36 45.6 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 127.005 2.122 . . . . 10.0 112.785 -178.677 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . 0.473 ' SG ' HD12 ' A' ' 6' ' ' ILE . 66.4 m -70.66 144.95 50.92 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.988 -1.07 . . . . 10.0 112.938 -173.536 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 91.3 m -100.54 -91.09 0.31 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.412 0.551 . . . . 10.0 110.526 -174.394 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -152.45 -50.03 0.11 Allowed 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 124.702 1.201 . . . . 10.0 109.57 179.154 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -52.96 -57.84 8.96 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.342 -0.849 . . . . 10.0 112.844 175.625 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -74.16 -28.61 61.39 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.443 1.02 . . . . 10.0 110.23 -179.021 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.28 -53.81 38.49 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.566 1.146 . . . . 10.0 111.206 -177.327 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.0 pttp -62.67 -49.73 73.97 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 107.362 -1.347 . . . . 10.0 107.362 179.426 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.95 -34.94 57.85 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.118 0.567 . . . . 10.0 112.247 175.811 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.51 -49.82 72.02 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.644 -0.66 . . . . 10.0 110.684 177.718 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 7.0 mt -67.65 -40.83 84.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.347 0.594 . . . . 10.0 111.768 176.572 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -57.83 -37.29 73.57 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.928 1.291 . . . . 10.0 111.435 172.804 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -54.26 -44.63 71.97 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.733 0.642 . . . . 10.0 112.733 176.796 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.495 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 1.2 mpp? -69.19 -74.05 0.14 Allowed 'General case' 0 CA--C 1.541 0.613 0 O-C-N 122.095 -0.378 . . . . 10.0 111.902 179.274 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 t -161.0 37.76 0.15 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.246 0.619 . . . . 10.0 112.3 178.496 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.255 2.5 ptpt 42.51 55.36 4.17 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.554 1.942 . . . . 10.0 114.741 174.613 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.624 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -158.86 -87.4 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.505 -0.77 . . . . 10.0 112.372 178.437 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.033 0 N-CA-C 115.687 1.736 . . . . 10.0 115.687 -163.512 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.53 0.211 0 N-CA-C 112.221 0.452 . . . . 10.0 112.221 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -147.03 112.69 5.66 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 124.028 0.931 . . . . 10.0 109.072 174.746 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -38.29 -41.64 0.63 Allowed 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.274 1.583 . . . . 10.0 115.274 166.155 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -58.04 -48.29 80.55 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.121 0.873 . . . . 10.0 110.404 171.399 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.22 -33.22 74.9 Favored 'General case' 0 N--CA 1.457 -0.122 0 O-C-N 121.795 -0.566 . . . . 10.0 110.37 -178.228 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 15.9 mm -65.84 -50.79 68.06 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-O 118.46 -0.781 . . . . 10.0 109.94 174.831 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.471 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -67.58 -40.39 84.83 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 117.379 -1.729 . . . . 10.0 111.15 -178.772 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -69.4 -22.68 63.68 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.971 1.708 . . . . 10.0 112.922 -178.704 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -92.69 -29.18 16.2 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.648 1.179 . . . . 10.0 113.206 170.663 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.92 -63.78 1.36 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.443 1.097 . . . . 10.0 112.734 -170.732 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.471 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.51 40.32 0.17 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.908 1.283 . . . . 10.0 111.131 178.962 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -127.6 1.57 6.17 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 114.254 1.205 . . . . 10.0 114.254 -164.158 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.7 t -96.75 -42.38 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 C-N-CA 124.918 1.287 . . . . 10.0 108.399 -179.139 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.2 m -105.33 -58.96 1.82 Allowed 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.666 1.986 . . . . 10.0 109.506 -169.428 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -74.26 -26.21 60.08 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.88 1.067 . . . . 10.0 113.88 -172.267 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.0 m -59.55 -47.86 83.9 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.415 0.686 . . . . 10.0 111.292 -177.961 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.6 tpt -106.83 -23.74 12.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.634 0.773 . . . . 10.0 111.932 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.04 57.99 1.63 Allowed Glycine 0 CA--C 1.535 1.323 0 C-N-CA 123.866 0.746 . . . . 10.0 112.234 -173.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 51.6 t -105.62 161.02 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 125.842 1.657 . . . . 10.0 109.518 -179.836 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 55.89 26.61 9.94 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.253 1.021 . . . . 10.0 112.693 -175.163 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.8 11.09 84.83 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.622 1.106 . . . . 10.0 113.944 -176.46 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.3 142.43 92.44 Favored Pre-proline 0 CA--C 1.548 0.87 0 CA-C-N 118.926 1.363 . . . . 10.0 113.761 -173.172 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -75.13 152.13 39.78 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 125.145 3.897 . . . . 10.0 110.529 -178.416 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.78 141.94 38.57 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -165.809 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.6 p -79.07 50.26 1.02 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.351 1.461 . . . . 10.0 113.43 -179.052 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -146.72 -39.71 0.21 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 115.623 1.712 . . . . 10.0 115.623 177.361 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.88 153.94 39.65 Favored 'General case' 0 C--O 1.226 -0.163 0 N-CA-C 108.211 -1.033 . . . . 10.0 108.211 179.289 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 34.1 m -96.13 -30.17 13.67 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 119.485 1.039 . . . . 10.0 110.267 174.251 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.39 -31.28 63.7 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.787 1.403 . . . . 10.0 114.787 -178.951 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -77.1 -31.41 55.84 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-O 121.792 0.806 . . . . 10.0 111.539 178.055 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.513 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 59.9 m95 -85.99 -33.6 21.04 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.119 2.167 . . . . 10.0 112.266 -178.265 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -46.94 -56.54 11.52 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.35 1.46 . . . . 10.0 113.424 175.5 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.35 14.97 0.21 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.321 2.681 . . . . 10.0 114.016 178.351 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.32 -52.65 2.48 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.014 1.726 . . . . 10.0 109.357 167.073 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.422 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -61.77 -19.2 62.22 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.642 1.577 . . . . 10.0 112.588 -179.204 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.13 -35.27 25.72 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 125.064 1.345 . . . . 10.0 109.601 -178.754 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -72.4 -50.36 27.0 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.175 171.12 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.496 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 162.68 -130.21 2.21 Favored Glycine 0 CA--C 1.533 1.177 0 N-CA-C 111.237 -0.745 . . . . 10.0 111.237 177.298 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.1 t -136.29 -58.84 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 123.753 0.821 . . . . 10.0 109.442 -178.01 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.67 11.08 0.06 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.607 1.963 . . . . 10.0 114.285 -177.701 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.496 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.2 OUTLIER -96.43 -20.97 18.04 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 127.104 2.161 . . . . 10.0 110.837 178.577 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -100.26 -41.56 7.03 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.108 0.563 . . . . 10.0 111.352 -178.65 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -52.89 -35.71 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 CA-C-O 121.279 0.562 . . . . 10.0 111.188 172.564 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.3 ptmt -64.77 -43.75 92.25 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.954 1.094 . . . . 10.0 113.954 170.303 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.8 -36.7 81.87 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.017 -1.052 . . . . 10.0 109.78 177.128 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 23.0 t -60.1 -57.89 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.837 0 C-N-CA 123.067 0.547 . . . . 10.0 110.385 176.139 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -55.84 -34.53 65.5 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 112.885 0.698 . . . . 10.0 112.885 177.579 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.5 m -72.05 -35.94 69.47 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 176.014 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.61 109.74 0.54 Allowed Glycine 0 CA--C 1.536 1.384 0 CA-C-N 119.324 0.966 . . . . 10.0 112.16 -173.027 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.55 -174.45 3.39 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.304 1.042 . . . . 10.0 111.412 175.322 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -51.58 -55.37 19.55 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 123.317 1.532 . . . . 10.0 112.973 -167.165 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -113.14 34.2 4.62 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 111.575 -2.557 . . . . 10.0 108.915 -176.758 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 44.9 ttp -138.46 123.75 12.2 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 177.799 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -65.91 160.79 42.41 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 122.688 2.259 . . . . 10.0 111.963 -177.739 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -59.57 127.43 23.67 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.784 2.323 . . . . 10.0 109.891 -178.654 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.64 10.58 85.81 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 114.403 0.521 . . . . 10.0 114.403 -173.16 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 62.18 30.54 76.13 Favored Glycine 0 CA--C 1.54 1.624 0 CA-C-N 119.199 1.499 . . . . 10.0 112.697 -178.761 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 80.25 55.15 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.815 2.046 . . . . 10.0 111.549 176.137 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -127.69 167.24 16.72 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.907 1.683 . . . . 10.0 110.956 178.082 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.2 m -118.02 -89.28 0.59 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.861 0.864 . . . . 10.0 110.528 176.987 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -93.2 66.31 4.03 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.444 1.098 . . . . 10.0 109.148 -176.034 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 53.7 m -120.92 129.14 53.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.119 -0.946 . . . . 10.0 111.606 -170.744 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 81.2 m -125.64 145.77 50.01 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 123.666 0.786 . . . . 10.0 110.789 -172.597 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -32.75 -43.2 0.09 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 128.025 2.53 . . . . 10.0 113.932 176.71 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -28.58 -62.04 0.11 Allowed 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.839 2.056 . . . . 10.0 114.321 164.946 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.82 -28.19 12.58 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.489 1.116 . . . . 10.0 112.178 178.581 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -51.89 -41.58 62.05 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.826 -1.171 . . . . 10.0 112.085 170.753 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.424 ' HG3' ' N ' ' A' ' 69' ' ' ALA . 51.4 pttt -62.56 -55.7 24.78 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 107.744 -1.206 . . . . 10.0 107.744 175.681 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.424 ' N ' ' HG3' ' A' ' 68' ' ' LYS . . . -51.38 -33.22 29.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.809 0.844 . . . . 10.0 111.31 -179.71 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.37 -38.85 78.24 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 123.764 0.826 . . . . 10.0 111.749 -179.284 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 10.4 mt -79.4 -47.3 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.355 1.462 . . . . 10.0 111.036 174.937 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -48.25 -42.66 31.11 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 127.116 2.166 . . . . 10.0 112.049 171.428 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -44.41 -44.47 8.39 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.648 0.779 . . . . 10.0 112.185 175.882 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.499 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 3.2 mpp? -75.32 -70.7 0.41 Allowed 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.696 0.284 . . . . 10.0 111.435 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -161.71 32.59 0.13 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.155 0.798 . . . . 10.0 113.155 -178.923 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 39.42 55.36 2.3 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.088 1.355 . . . . 10.0 113.577 -179.098 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.444 ' HB3' ' HE3' ' A' ' 31' ' ' TRP . . . -140.08 -61.85 0.52 Allowed 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.532 -0.758 . . . . 10.0 112.372 178.78 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.513 ' HE3' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.731 0 N-CA-C 115.202 1.556 . . . . 10.0 115.202 -163.967 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 114.131 1.16 . . . . 10.0 114.131 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -156.61 159.87 38.88 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.529 1.532 . . . . 10.0 107.356 -174.95 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.51 -41.96 26.25 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 128.061 2.545 . . . . 10.0 112.082 179.116 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -57.14 -48.6 78.28 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 121.428 0.632 . . . . 10.0 109.702 175.011 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.91 -33.86 76.51 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.345 -175.63 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.0 mt -65.2 -52.22 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 CA-C-O 118.798 -0.62 . . . . 10.0 109.699 176.221 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.42 -38.12 80.92 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 117.142 -1.823 . . . . 10.0 111.313 -177.975 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -69.22 -22.48 63.87 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.69 1.596 . . . . 10.0 113.134 -179.438 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.94 -28.41 14.69 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.999 0.92 . . . . 10.0 113.241 170.631 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.1 -66.33 1.08 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.439 1.096 . . . . 10.0 112.474 -171.187 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.15 43.24 0.21 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 124.781 1.232 . . . . 10.0 111.127 178.12 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.8 t -129.24 -6.62 4.83 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 125.195 1.398 . . . . 10.0 113.816 -164.886 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.6 t -94.79 -43.98 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 124.052 0.941 . . . . 10.0 108.781 -175.245 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.0 m -104.43 -54.55 2.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 125.671 1.589 . . . . 10.0 109.257 -169.713 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -73.59 -13.41 61.01 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.351 1.46 . . . . 10.0 114.081 -172.896 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.3 t -73.01 -43.25 62.36 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.77 -0.581 . . . . 10.0 110.494 -178.144 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 16.3 tpp -112.18 -37.5 5.02 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.936 1.294 . . . . 10.0 112.999 179.917 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.98 58.98 1.27 Allowed Glycine 0 CA--C 1.534 1.268 0 C-N-CA 125.236 1.398 . . . . 10.0 113.461 -178.591 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 89.7 t -79.8 -60.28 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.615 -0.932 . . . . 10.0 112.711 -175.431 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.47 30.74 0.41 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.716 0.806 . . . . 10.0 111.171 178.884 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.57 6.69 81.72 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 124.348 0.975 . . . . 10.0 113.58 -173.466 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.43 135.83 69.97 Favored Pre-proline 0 CA--C 1.544 0.732 0 CA-C-N 118.07 0.935 . . . . 10.0 112.529 -176.272 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -69.36 149.83 69.93 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.917 3.078 . . . . 10.0 111.111 -175.335 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.63 134.48 39.3 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.156 0.583 . . . . 10.0 110.871 -163.985 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 94.8 p -39.7 -41.33 1.06 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.006 1.323 . . . . 10.0 114.1 178.142 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 26.6 p-80 -131.94 113.64 13.67 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.033 1.733 . . . . 10.0 109.701 173.094 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -149.53 162.19 40.64 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.927 1.691 . . . . 10.0 107.682 174.167 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 99.5 m -107.53 -37.08 6.29 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.596 0.635 . . . . 10.0 111.686 170.127 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.36 -24.94 39.45 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 121.188 -0.945 . . . . 10.0 112.629 -176.76 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -77.33 -39.0 49.19 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.699 1.6 . . . . 10.0 108.947 177.879 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.461 ' CH2' ' HG3' ' A' ' 78' ' ' LYS . 60.1 m95 -80.87 -34.83 33.39 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.21 1.804 . . . . 10.0 112.427 179.568 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -40.18 -61.1 1.23 Allowed Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 115.033 1.494 . . . . 10.0 115.033 172.798 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -68.42 -4.67 13.38 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.333 2.689 . . . . 10.0 113.897 -179.014 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.0 -47.97 6.74 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.124 0.97 . . . . 10.0 108.652 172.234 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.72 16.76 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.83 1.652 . . . . 10.0 115.277 171.699 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.01 -24.05 22.45 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 120.99 -1.069 . . . . 10.0 110.835 -178.071 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.7 mptt -101.16 -48.78 4.29 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.024 0.93 . . . . 10.0 109.868 173.632 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.5 -124.73 1.85 Allowed Glycine 0 CA--C 1.528 0.855 0 N-CA-C 110.412 -1.075 . . . . 10.0 110.412 172.928 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -117.41 175.48 3.25 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.132 0 C-N-CA 125.316 1.446 . . . . 10.0 110.581 175.601 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 70.79 -45.04 0.6 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.078 1.751 . . . . 10.0 112.035 -174.868 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -44.0 -37.59 3.05 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.503 1.047 . . . . 10.0 111.928 -177.424 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -81.03 -43.6 19.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 125.677 1.591 . . . . 10.0 112.227 -179.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.81 -31.7 47.97 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 CA-C-O 121.545 0.688 . . . . 10.0 110.09 175.68 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -60.64 -51.06 70.98 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.579 -0.701 . . . . 10.0 112.284 169.871 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 54.1 m -62.28 -35.8 80.13 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 121.128 -0.983 . . . . 10.0 110.296 178.322 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.6 t -61.77 -54.8 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 C-N-CA 123.246 0.618 . . . . 10.0 111.294 177.413 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.72 -36.28 67.06 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 111.928 0.344 . . . . 10.0 111.928 177.059 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 50.0 m -72.37 -40.9 66.95 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.29 0.636 . . . . 10.0 112.566 178.26 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.32 114.86 0.77 Allowed Glycine 0 CA--C 1.528 0.861 0 N-CA-C 111.048 -0.821 . . . . 10.0 111.048 -168.103 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.91 -163.68 0.11 Allowed 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.436 0.695 . . . . 10.0 110.374 169.199 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -71.06 -62.58 1.34 Allowed 'General case' 0 N--CA 1.471 0.584 0 O-C-N 119.839 -1.788 . . . . 10.0 111.353 -172.445 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.74 -14.93 60.34 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.894 1.278 . . . . 10.0 112.586 173.717 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.8 ttp -102.69 120.79 51.73 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 123.181 0.592 . . . . 10.0 112.134 -172.582 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.33 155.26 70.85 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.079 1.852 . . . . 10.0 112.128 -173.183 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -57.94 130.21 37.14 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.373 2.715 . . . . 10.0 110.461 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.53 29.83 75.44 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 118.458 -1.19 . . . . 10.0 113.968 -172.4 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.4 29.3 3.75 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-N 118.984 1.392 . . . . 10.0 115.688 168.703 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.1 ttt 62.5 35.41 14.64 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.271 1.828 . . . . 10.0 114.195 -173.5 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.7 t -123.91 70.02 1.07 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.763 2.025 . . . . 10.0 109.427 -178.28 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 72.7 p 11.55 -96.42 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 128.82 2.848 . . . . 10.0 115.675 -178.826 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -125.7 54.87 1.47 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.913 1.285 . . . . 10.0 109.475 173.541 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 84.1 m -69.67 134.99 49.33 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.337 -0.852 . . . . 10.0 112.503 -178.655 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.59 140.39 33.86 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.622 1.169 . . . . 10.0 110.069 -178.184 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -39.27 -37.11 0.39 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.666 1.986 . . . . 10.0 113.496 176.711 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -36.39 -59.74 0.62 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.549 1.54 . . . . 10.0 113.539 166.147 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -97.59 -25.43 15.14 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.581 0.752 . . . . 10.0 110.992 179.762 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -54.18 48.96 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 120.826 -1.171 . . . . 10.0 110.612 176.276 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -61.83 -40.63 95.97 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.967 0.907 . . . . 10.0 110.219 -176.426 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -57.89 -30.75 66.12 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.949 -0.47 . . . . 10.0 111.735 171.007 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.77 -40.25 33.74 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 120.781 -1.199 . . . . 10.0 110.526 -173.001 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -43.03 78.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 122.799 0.439 . . . . 10.0 111.055 172.801 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -30.96 71.84 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.524 -0.735 . . . . 10.0 111.636 179.286 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -51.05 -48.23 61.58 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.873 -0.517 . . . . 10.0 112.241 171.454 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -64.51 -47.24 79.64 Favored 'General case' 0 CA--C 1.532 0.26 0 O-C-N 121.734 -0.604 . . . . 10.0 111.496 174.073 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.9 t -164.28 -78.18 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 120.28 -0.568 . . . . 10.0 111.72 175.98 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.3 pttt 163.09 45.03 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.659 2.784 . . . . 10.0 109.501 -176.624 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -152.45 -81.05 0.1 Allowed 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 114.528 1.307 . . . . 10.0 114.528 166.617 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.461 ' HG3' ' CH2' ' A' ' 31' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.254 1.299 0 N-CA-C 117.347 2.351 . . . . 10.0 117.347 -165.816 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.1 0 N-CA-C 111.443 0.164 . . . . 10.0 111.443 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -143.62 115.11 8.08 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 123.666 0.786 . . . . 10.0 109.177 172.02 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.417 ' HB1' ' N ' ' A' ' 70' ' ' ALA . . . -43.87 -36.99 2.6 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.2 1.185 . . . . 10.0 114.2 167.997 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -54.49 -50.81 66.9 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 118.716 0.689 . . . . 10.0 110.468 170.533 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.74 -34.12 76.21 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 121.878 -0.513 . . . . 10.0 110.173 -175.638 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.2 mm -66.23 -51.05 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-O 118.041 -0.981 . . . . 10.0 110.113 176.42 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.405 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -67.59 -40.11 84.79 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 117.353 -1.739 . . . . 10.0 111.115 -179.916 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -69.07 -22.54 64.01 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.362 1.465 . . . . 10.0 112.637 -176.424 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -97.11 -26.66 14.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.443 1.097 . . . . 10.0 113.572 170.863 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -103.26 -68.35 0.84 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.954 1.302 . . . . 10.0 113.042 -175.599 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.405 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.65 41.99 0.28 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.469 1.508 . . . . 10.0 110.837 -178.476 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.4 t -126.76 -0.38 6.71 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 124.596 1.158 . . . . 10.0 113.52 -163.683 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 t -104.11 -53.14 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 C-N-CA 125.047 1.339 . . . . 10.0 108.573 -174.609 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.7 m -80.34 -65.8 0.96 Allowed 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.213 1.805 . . . . 10.0 110.192 176.333 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -72.91 -15.75 61.57 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.648 1.179 . . . . 10.0 113.983 -164.425 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.1 t -69.57 -41.24 76.09 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.827 -0.545 . . . . 10.0 110.829 -178.139 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.6 tpt -117.66 -35.76 3.86 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.889 1.276 . . . . 10.0 112.893 -177.468 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.89 56.46 1.31 Allowed Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.199 1.38 . . . . 10.0 113.693 179.927 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 64.0 t -78.49 -55.17 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 O-C-N 121.769 -0.842 . . . . 10.0 112.763 -176.046 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.05 32.83 0.44 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.739 0.815 . . . . 10.0 111.339 -179.076 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 62.0 32.21 81.37 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 123.926 0.774 . . . . 10.0 111.859 -169.914 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.65 148.23 82.39 Favored Pre-proline 0 CA--C 1.543 0.677 0 C-N-CA 123.656 0.782 . . . . 10.0 111.794 179.798 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -71.58 155.04 59.78 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 124.624 3.549 . . . . 10.0 110.481 -179.175 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -79.5 136.63 36.96 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.753 -0.592 . . . . 10.0 111.183 -172.525 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.7 m -37.13 -35.84 0.12 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.783 1.633 . . . . 10.0 114.67 169.742 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.4 p80 -131.81 117.44 18.55 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.374 1.07 . . . . 10.0 109.425 171.268 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.464 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . 3.2 m-20 -153.33 162.46 41.26 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 106.593 -1.632 . . . . 10.0 106.593 170.858 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 86.9 m -110.43 -36.35 5.8 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 118.21 0.459 . . . . 10.0 111.642 168.552 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.86 -25.24 37.81 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.289 -0.882 . . . . 10.0 113.046 -175.797 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . 0.464 ' HB3' ' HB3' ' A' ' 27' ' ' ASN . 65.1 t0 -79.18 -31.48 43.89 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.983 1.713 . . . . 10.0 109.383 176.057 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.49 ' CH2' ' HG3' ' A' ' 78' ' ' LYS . 56.7 m95 -84.02 -34.76 24.23 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.813 1.245 . . . . 10.0 111.285 179.481 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.85 -58.99 2.8 Favored Pre-proline 0 CA--C 1.551 0.984 0 N-CA-C 114.415 1.265 . . . . 10.0 114.415 173.451 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -73.72 6.79 2.64 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.33 2.687 . . . . 10.0 114.065 -178.784 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.74 -42.0 5.51 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.981 0.912 . . . . 10.0 108.67 169.659 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.89 22.1 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 115.159 1.54 . . . . 10.0 115.159 164.73 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.18 -36.96 14.49 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 120.955 -1.091 . . . . 10.0 110.023 178.768 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -76.35 -54.94 6.04 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.977 174.005 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 136.37 50.76 0.07 OUTLIER Glycine 0 CA--C 1.534 1.261 0 CA-C-O 119.334 -0.703 . . . . 10.0 114.808 168.483 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.9 t 62.03 165.36 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.861 1.264 . . . . 10.0 111.906 -179.67 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 77.41 -50.96 0.54 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.417 1.487 . . . . 10.0 110.738 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -38.23 -41.08 0.57 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.655 1.182 . . . . 10.0 111.942 172.091 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -68.37 -50.89 49.95 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 124.596 1.158 . . . . 10.0 111.293 -179.436 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.57 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.4 OUTLIER -50.45 -29.29 6.28 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 C-N-CA 124.321 1.049 . . . . 10.0 112.357 167.541 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.509 ' HE3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -81.67 -37.36 27.55 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 120.676 -1.265 . . . . 10.0 114.362 173.64 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.5 m -76.0 -16.9 59.89 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.451 1.1 . . . . 10.0 111.421 173.767 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.57 HG12 ' HA ' ' A' ' 43' ' ' VAL . 4.5 p -89.05 -41.23 13.82 Favored 'Isoleucine or valine' 0 C--N 1.34 0.167 0 O-C-N 121.666 -0.646 . . . . 10.0 111.801 175.119 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.411 ' HA ' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -53.11 -39.3 63.32 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.91 0.862 . . . . 10.0 110.942 177.315 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.5 t -73.34 -39.1 65.48 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.277 1.431 . . . . 10.0 112.243 178.256 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 82.5 99.84 0.47 Allowed Glycine 0 CA--C 1.532 1.124 0 C-N-CA 123.36 0.505 . . . . 10.0 111.99 -174.961 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.6 tp -58.56 168.88 1.03 Allowed 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.947 -0.737 . . . . 10.0 111.693 170.026 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.474 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 10.9 m-80 -46.96 -57.96 4.45 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.531 1.532 . . . . 10.0 113.547 -174.336 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.69 14.77 7.87 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 114.367 -1.288 . . . . 10.0 112.538 177.138 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -110.96 153.51 43.78 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 114.795 1.406 . . . . 10.0 114.795 171.678 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -72.58 154.13 54.88 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.564 2.176 . . . . 10.0 110.737 169.327 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -62.09 132.41 39.09 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.641 2.227 . . . . 10.0 108.408 175.783 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.411 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 63.11 30.21 76.79 Favored Glycine 0 C--N 1.338 0.648 0 C-N-CA 118.946 -1.597 . . . . 10.0 112.357 179.697 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.57 32.28 2.8 Favored Glycine 0 CA--C 1.541 1.668 0 CA-C-N 118.076 0.938 . . . . 10.0 113.987 -179.121 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.1 ttt 70.19 44.42 0.76 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.019 1.728 . . . . 10.0 113.224 -176.438 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.07 156.32 40.17 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.99 1.316 . . . . 10.0 111.572 178.555 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 49.0 m -112.16 -91.97 0.48 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.275 1.03 . . . . 10.0 109.74 -179.257 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -89.8 66.53 7.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.875 1.27 . . . . 10.0 109.52 178.625 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 62.7 m -117.96 127.24 53.64 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.558 1.143 . . . . 10.0 111.429 -176.126 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 85.6 m -122.57 146.14 47.7 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.75 0.82 . . . . 10.0 109.927 -173.129 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -37.26 -42.45 0.46 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.983 2.113 . . . . 10.0 113.43 -178.406 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -35.87 -53.2 0.74 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.263 1.425 . . . . 10.0 113.905 172.296 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.56 -33.51 10.29 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.741 0.816 . . . . 10.0 111.655 173.823 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.04 -40.13 57.53 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.616 -1.302 . . . . 10.0 112.043 177.981 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.2 pttt -69.1 -48.25 63.09 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 123.387 0.675 . . . . 10.0 109.972 178.053 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.25 -32.34 62.25 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.374 0.534 . . . . 10.0 111.802 175.102 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.417 ' N ' ' HB1' ' A' ' 3' ' ' ALA . . . -67.54 -42.45 82.68 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.985 0.914 . . . . 10.0 109.934 -178.76 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -67.92 -51.83 45.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 125.999 1.72 . . . . 10.0 111.773 173.193 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -58.81 -32.7 69.6 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.236 1.415 . . . . 10.0 111.966 178.057 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -47.3 -50.46 21.59 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.275 0.488 . . . . 10.0 111.845 175.987 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.459 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.2 mpp? -66.73 -45.71 77.79 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.966 0.358 . . . . 10.0 111.966 179.002 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.2 t -162.59 -71.48 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.015 0.526 . . . . 10.0 111.567 176.712 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.2 pttt 160.43 50.11 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.38 2.672 . . . . 10.0 110.972 -175.097 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.1 -80.95 0.05 OUTLIER 'General case' 0 C--O 1.224 -0.282 0 O-C-N 121.271 -0.893 . . . . 10.0 113.043 171.711 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.49 ' HG3' ' CH2' ' A' ' 31' ' ' TRP . 6.4 ptpp? . . . . . 0 C--O 1.251 1.158 0 N-CA-C 114.832 1.419 . . . . 10.0 114.832 -178.584 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 . . . . . 0 CA--C 1.542 0.653 0 N-CA-C 114.313 1.227 . . . . 10.0 114.313 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . 0.425 ' C ' HD13 ' A' ' 6' ' ' ILE . 23.1 t70 -134.81 -129.49 0.16 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.591 1.556 . . . . 10.0 111.28 -167.518 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.7 -52.2 0.15 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 129.977 3.311 . . . . 10.0 109.112 -173.77 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -57.67 -49.28 77.02 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 121.441 0.639 . . . . 10.0 110.154 174.35 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.61 -30.9 70.61 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.902 -0.499 . . . . 10.0 110.775 -176.11 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.425 HD13 ' C ' ' A' ' 2' ' ' ASP . 1.7 mp -67.95 -51.5 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 N-CA-C 108.678 -0.86 . . . . 10.0 108.678 -179.835 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.36 -42.84 78.62 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 119.625 -0.83 . . . . 10.0 110.837 178.811 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -67.35 -22.4 65.59 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.002 1.321 . . . . 10.0 111.94 -176.13 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.77 -30.81 16.81 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.015 1.117 . . . . 10.0 114.015 167.303 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.03 -65.64 1.14 Allowed 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.893 1.224 . . . . 10.0 113.147 -171.094 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.28 43.83 0.31 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.146 1.378 . . . . 10.0 110.175 178.412 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.9 t -124.63 -3.25 7.82 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 125.076 1.35 . . . . 10.0 113.803 -166.254 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -103.2 -48.11 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 124.312 1.045 . . . . 10.0 108.554 -174.268 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.4 m -85.09 -66.28 0.91 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.748 1.619 . . . . 10.0 110.757 174.157 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -73.87 -19.37 60.74 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.824 1.416 . . . . 10.0 114.824 -163.22 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.2 t -64.79 -54.83 25.02 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.038 0.535 . . . . 10.0 111.035 175.543 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.7 tpt -97.0 -20.16 18.26 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.725 0.81 . . . . 10.0 112.747 -177.841 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.58 42.67 6.4 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 125.563 1.554 . . . . 10.0 112.3 -173.665 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 15.3 t -81.01 159.28 4.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 O-C-N 121.693 -0.886 . . . . 10.0 109.146 176.505 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.53 19.84 5.65 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.914 1.286 . . . . 10.0 113.37 -174.939 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.6 24.35 76.34 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 123.906 0.765 . . . . 10.0 113.127 -173.476 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.43 145.32 87.67 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 118.596 1.198 . . . . 10.0 113.533 -177.782 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -75.17 145.9 31.41 Favored 'Trans proline' 0 N--CA 1.454 -0.828 1 C-N-CA 125.512 4.142 . . . . 10.0 109.825 -179.993 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -66.77 152.41 45.56 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-O 122.354 1.073 . . . . 10.0 112.137 -167.048 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.6 p -49.26 -33.18 12.27 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.721 1.608 . . . . 10.0 112.592 167.426 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -142.1 74.14 1.44 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.151 1.38 . . . . 10.0 111.947 -177.335 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 15.5 m-20 -103.41 166.27 10.53 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.767 1.227 . . . . 10.0 108.927 166.928 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.5 t -110.19 -36.03 5.94 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 166.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.87 -23.92 41.57 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.654 -1.279 . . . . 10.0 112.535 -176.86 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -79.21 -29.79 42.98 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.165 1.386 . . . . 10.0 110.509 178.455 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.465 ' HE3' ' HB3' ' A' ' 77' ' ' ALA . 57.7 m95 -89.64 -38.59 13.8 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.322 1.849 . . . . 10.0 111.091 -179.495 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -39.43 -61.97 0.9 Allowed Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 114.709 1.374 . . . . 10.0 114.709 174.961 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.04 -1.82 9.35 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.353 2.702 . . . . 10.0 113.862 -177.572 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 56.1 mmt-85 -98.9 -47.31 5.32 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.486 1.514 . . . . 10.0 108.695 176.665 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.15 -10.16 4.12 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 126.227 1.811 . . . . 10.0 113.656 172.762 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.81 -27.74 58.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.17 1.388 . . . . 10.0 109.503 178.179 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -92.96 -56.87 2.83 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.856 0.463 . . . . 10.0 110.51 169.412 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.487 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 165.47 -122.39 1.07 Allowed Glycine 0 CA--C 1.529 0.928 0 N-CA-C 111.567 -0.613 . . . . 10.0 111.567 179.864 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.3 p -151.4 -56.42 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 117.719 0.759 . . . . 10.0 111.352 -178.777 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.07 1.78 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.999 1.481 . . . . 10.0 114.999 171.748 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.487 HD21 ' N ' ' A' ' 38' ' ' GLY . 1.9 m-80 -69.7 -59.39 2.98 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.085 -1.009 . . . . 10.0 109.806 164.824 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.9 mp -80.09 -20.89 44.05 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.38 -0.825 . . . . 10.0 111.042 -166.436 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.437 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.4 OUTLIER -59.13 -15.68 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 124.285 1.034 . . . . 10.0 112.452 164.005 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -82.57 -35.21 27.36 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.086 -1.009 . . . . 10.0 111.819 168.15 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 7.8 t -69.69 -44.77 69.73 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 123.481 0.713 . . . . 10.0 110.277 177.663 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . 0.437 HG12 ' HA ' ' A' ' 43' ' ' VAL . 3.6 p -58.58 -41.61 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 123.24 0.616 . . . . 10.0 111.632 -179.148 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.407 ' NZ ' ' OD1' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -70.88 -28.51 64.61 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.966 -0.459 . . . . 10.0 111.781 179.505 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.3 m -76.23 -35.09 59.18 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.865 1.266 . . . . 10.0 112.507 172.656 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.72 105.05 0.3 Allowed Glycine 0 CA--C 1.525 0.684 0 C-N-CA 123.727 0.679 . . . . 10.0 111.873 -170.345 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.4 tp -68.07 174.51 3.77 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 122.095 -0.65 . . . . 10.0 110.252 170.338 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.488 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 15.3 m-80 -49.57 -54.75 16.44 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.598 -1.314 . . . . 10.0 113.138 -172.67 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -88.78 16.02 7.44 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.398 1.479 . . . . 10.0 112.95 175.76 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -122.98 142.96 39.42 Favored Pre-proline 0 CA--C 1.545 0.784 0 N-CA-C 115.024 1.49 . . . . 10.0 115.024 175.955 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.64 139.92 41.86 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 121.885 1.723 . . . . 10.0 110.835 177.171 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -60.95 119.91 7.33 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.938 2.425 . . . . 10.0 109.582 177.187 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.402 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 86.93 12.65 68.08 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 119.625 -1.274 . . . . 10.0 112.643 -175.343 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 60.29 14.6 34.24 Favored Glycine 0 CA--C 1.54 1.614 0 CA-C-N 119.478 1.639 . . . . 10.0 114.579 171.415 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.4 ttt 41.82 45.62 3.18 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.445 2.298 . . . . 10.0 114.525 -175.357 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.8 p -115.56 24.86 11.23 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.628 1.171 . . . . 10.0 113.388 178.63 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.6 m 65.0 -127.97 0.35 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.699 0.8 . . . . 10.0 110.422 177.087 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -79.29 60.0 2.98 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.826 1.25 . . . . 10.0 110.999 -179.304 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 2.8 m -60.9 96.34 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.995 0.918 . . . . 10.0 112.076 -177.452 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.3 t -88.46 129.66 35.38 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 121.072 -1.017 . . . . 10.0 108.386 176.672 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.407 ' OD1' ' NZ ' ' A' ' 47' ' ' LYS . 5.8 m-20 -38.83 -38.5 0.43 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.979 1.712 . . . . 10.0 113.137 178.514 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -43.4 -59.44 2.13 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.264 1.425 . . . . 10.0 112.23 169.183 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -80.7 -37.4 30.73 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.965 0.888 . . . . 10.0 110.344 -179.231 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.6 -46.88 73.89 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.394 1.078 . . . . 10.0 111.161 -179.3 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.8 pttt -72.77 -47.61 45.25 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 124.386 1.074 . . . . 10.0 108.869 -179.639 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.63 -41.1 21.27 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.73 0.412 . . . . 10.0 111.791 173.727 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.76 -53.78 53.16 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.224 0.609 . . . . 10.0 111.237 179.758 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 31.7 pt -71.65 -31.5 42.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 O-C-N 120.961 -1.087 . . . . 10.0 112.84 179.579 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -58.24 -40.45 81.77 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.409 0.684 . . . . 10.0 111.352 167.478 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -51.82 -43.76 63.25 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.508 0.559 . . . . 10.0 112.508 177.165 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -70.37 0.27 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.909 0.337 . . . . 10.0 111.909 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.2 t -162.45 31.56 0.11 Allowed 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.833 0.679 . . . . 10.0 112.833 -178.973 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.4 ptpt 35.58 51.1 0.64 Allowed 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 115.624 1.713 . . . . 10.0 115.624 178.786 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.465 ' HB3' ' HE3' ' A' ' 31' ' ' TRP . . . -132.17 -49.82 0.94 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.629 0.974 . . . . 10.0 113.629 -176.092 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 12.7 pttp . . . . . 0 C--O 1.249 1.049 0 CA-C-O 116.606 -1.664 . . . . 10.0 112.08 -177.266 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 . . . . . 0 CA--C 1.531 0.244 0 N-CA-C 112.759 0.652 . . . . 10.0 112.759 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -152.0 114.58 4.58 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 121.951 0.882 . . . . 10.0 109.32 174.98 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.481 ' HB1' ' N ' ' A' ' 70' ' ' ALA . . . -56.25 -28.25 57.86 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 114.212 1.19 . . . . 10.0 114.212 174.31 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -56.24 -48.33 76.72 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 119.093 0.86 . . . . 10.0 110.426 166.812 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 -34.55 76.48 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.792 -0.568 . . . . 10.0 110.176 -178.019 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.2 mm -65.49 -51.17 66.8 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 CA-C-O 118.871 -0.585 . . . . 10.0 109.668 176.939 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.454 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -68.11 -41.1 82.29 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 118.176 -1.41 . . . . 10.0 111.014 -178.899 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -69.05 -22.28 64.04 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.363 1.465 . . . . 10.0 112.755 -178.06 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.45 -29.07 16.45 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.31 1.044 . . . . 10.0 113.554 168.559 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.3 -65.08 1.19 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.806 1.185 . . . . 10.0 112.952 -172.192 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.454 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -74.46 39.74 0.13 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.542 1.537 . . . . 10.0 111.322 178.655 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.7 t -126.71 3.34 6.74 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 125.084 1.353 . . . . 10.0 113.676 -165.16 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.3 t -100.91 -38.72 6.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 124.604 1.162 . . . . 10.0 108.685 -177.355 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.3 m -110.28 -58.73 2.03 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 126.263 1.825 . . . . 10.0 109.65 -170.275 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 26.3 m-70 -73.48 -25.7 60.58 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.289 0.848 . . . . 10.0 113.289 -173.394 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.18 -51.27 64.9 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.903 0.881 . . . . 10.0 110.499 -177.393 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -111.44 -23.29 10.84 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.771 1.228 . . . . 10.0 112.358 -177.878 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.83 59.96 1.16 Allowed Glycine 0 CA--C 1.537 1.44 0 C-N-CA 124.381 0.991 . . . . 10.0 112.518 -175.513 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 25.6 t -104.74 159.65 5.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 125.515 1.526 . . . . 10.0 109.638 178.237 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.54 23.08 10.41 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.441 1.096 . . . . 10.0 113.178 -176.08 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.24 10.06 86.46 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.304 0.954 . . . . 10.0 113.468 -174.441 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.51 149.62 98.26 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 118.622 1.211 . . . . 10.0 111.451 179.087 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -76.41 163.94 31.5 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 123.859 3.039 . . . . 10.0 110.09 -177.398 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -71.31 141.04 50.49 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.589 -0.694 . . . . 10.0 111.776 -178.087 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.7 t -35.63 -37.79 0.1 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 127.233 2.213 . . . . 10.0 114.327 171.444 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.4 p-80 -139.57 118.43 12.46 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 108.106 -1.072 . . . . 10.0 108.106 168.812 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -138.19 161.2 37.45 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.299 -1.371 . . . . 10.0 107.299 168.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.7 t -106.55 -33.24 7.74 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 117.514 0.143 . . . . 10.0 111.255 169.335 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.84 -36.1 70.07 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 120.412 -1.43 . . . . 10.0 113.485 -179.941 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -80.54 -21.87 41.39 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.033 0.533 . . . . 10.0 110.908 -178.314 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 62.9 m95 -93.87 -34.88 12.96 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.659 1.583 . . . . 10.0 109.945 -178.21 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -41.39 -63.02 0.89 Allowed Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 124.786 1.234 . . . . 10.0 114.296 175.003 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -73.24 5.42 3.15 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.86 2.373 . . . . 10.0 113.975 -178.224 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -106.37 -44.08 4.61 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.476 1.91 . . . . 10.0 109.463 174.081 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.25 12.21 0.47 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.755 2.022 . . . . 10.0 113.191 173.764 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.94 -27.69 28.35 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 125.124 1.369 . . . . 10.0 109.914 177.649 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -90.93 -56.78 3.05 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.142 0.577 . . . . 10.0 110.831 175.218 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 150.32 -124.78 1.81 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 110.949 -0.86 . . . . 10.0 110.949 175.748 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -126.23 177.55 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 125.528 1.531 . . . . 10.0 110.041 176.335 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.49 ' HA ' HG12 ' A' ' 43' ' ' VAL . 7.6 t70 73.8 -43.55 0.55 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.779 1.231 . . . . 10.0 111.614 -171.249 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.32 -48.7 65.28 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 120.691 -1.256 . . . . 10.0 112.537 -174.028 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.7 mt -88.54 -37.67 15.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.603 1.161 . . . . 10.0 111.011 -173.513 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.49 HG12 ' HA ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER -58.26 -29.19 36.96 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.426 0.631 . . . . 10.0 110.382 171.699 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.4 mtpt -63.86 -52.48 59.85 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 120.395 -1.441 . . . . 10.0 114.243 168.884 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.23 -33.12 70.62 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.155 -0.966 . . . . 10.0 109.872 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.54 -42.03 83.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 115.352 -0.84 . . . . 10.0 111.985 174.954 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.437 ' HA ' ' HA2' ' A' ' 56' ' ' GLY . 0.1 OUTLIER -81.82 -25.54 35.08 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.446 0.641 . . . . 10.0 111.71 -177.776 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 54.9 m -73.55 -32.98 64.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.944 0.897 . . . . 10.0 112.312 174.03 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 89.54 124.19 2.51 Favored Glycine 0 C--N 1.343 0.923 0 CA-C-N 119.755 1.161 . . . . 10.0 111.634 -174.194 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.43 -157.54 0.79 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.139 0.976 . . . . 10.0 111.91 176.155 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -68.03 138.48 55.88 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-O 122.524 1.154 . . . . 10.0 109.508 -179.311 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 56.29 18.86 3.58 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 111.516 -2.584 . . . . 10.0 112.003 176.459 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.0 ttp -136.89 121.64 12.64 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 123.993 0.917 . . . . 10.0 111.265 -171.733 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -68.36 143.89 59.84 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 121.602 1.535 . . . . 10.0 111.632 -174.971 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -62.16 113.95 2.11 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.43 2.753 . . . . 10.0 109.618 178.685 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.437 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 104.84 20.62 9.76 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 123.488 0.493 . . . . 10.0 112.75 -175.502 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 51.39 34.45 33.97 Favored Glycine 0 CA--C 1.54 1.605 0 CA-C-N 119.286 1.543 . . . . 10.0 114.116 177.434 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.0 ttt 65.16 23.12 12.31 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.15 1.78 . . . . 10.0 113.222 -176.554 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.3 t -121.91 155.61 35.1 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.725 1.21 . . . . 10.0 112.06 -170.732 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 80.2 m -88.49 -66.38 0.92 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.646 0.779 . . . . 10.0 111.139 179.736 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -124.46 63.78 1.1 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.403 1.081 . . . . 10.0 109.416 -177.747 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.0 m -81.54 118.89 23.12 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 121.686 -0.634 . . . . 10.0 110.45 172.01 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 62.2 m -108.28 135.44 49.6 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 108.345 -0.983 . . . . 10.0 108.345 179.707 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -32.38 -46.09 0.12 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.722 2.009 . . . . 10.0 114.477 -179.719 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -28.35 -60.85 0.12 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.682 1.993 . . . . 10.0 113.324 167.779 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.18 -37.14 12.26 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.937 0.895 . . . . 10.0 111.988 173.127 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.67 -39.07 50.03 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.985 -1.072 . . . . 10.0 112.311 -177.373 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.7 ptmt -75.51 -50.62 15.14 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.746 1.219 . . . . 10.0 109.361 178.671 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.87 -30.81 15.5 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.575 0.75 . . . . 10.0 111.955 179.174 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.481 ' N ' ' HB1' ' A' ' 3' ' ' ALA . . . -63.05 -44.85 94.69 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.546 0.738 . . . . 10.0 111.663 175.257 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 19.0 mt -73.18 -41.22 58.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 126.681 1.992 . . . . 10.0 111.086 177.425 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -63.83 -33.79 76.47 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.583 1.153 . . . . 10.0 111.862 174.836 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -55.13 -34.36 63.66 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 112.496 0.554 . . . . 10.0 112.496 171.282 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 65.6 mtm -86.43 -72.48 0.5 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.709 0.804 . . . . 10.0 112.229 -178.839 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -158.34 34.16 0.24 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.515 0.561 . . . . 10.0 112.515 178.064 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt 42.68 52.28 4.96 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.748 1.619 . . . . 10.0 113.86 172.237 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -158.94 -81.73 0.05 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.481 1.112 . . . . 10.0 112.656 173.233 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.229 0 N-CA-C 115.66 1.726 . . . . 10.0 115.66 -171.058 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.466 0.327 0 N-CA-C 113.468 0.914 . . . . 10.0 113.468 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -146.05 -175.79 4.9 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 105.437 -2.06 . . . . 10.0 105.437 177.04 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.545 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . . . -93.58 -44.32 8.26 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 126.215 1.806 . . . . 10.0 112.941 169.023 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -54.41 -37.74 65.42 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.528 0.68 . . . . 10.0 110.163 -177.451 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.94 -28.96 43.79 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.905 0.882 . . . . 10.0 113.087 174.802 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.28 -51.39 43.4 Favored 'Isoleucine or valine' 0 C--N 1.339 0.126 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 179.629 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -68.05 -29.46 68.44 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.363 -0.836 . . . . 10.0 111.035 -176.36 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.11 -23.29 65.82 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 126.072 1.749 . . . . 10.0 114.069 174.063 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 tppt? -100.66 -27.89 13.14 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.357 0.873 . . . . 10.0 113.357 172.174 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.99 -72.3 0.73 Allowed 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 124.988 1.315 . . . . 10.0 110.978 -167.068 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.74 37.3 0.14 Allowed 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.731 1.212 . . . . 10.0 110.667 179.043 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.0 t -120.53 -1.99 10.03 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.023 1.729 . . . . 10.0 114.041 -169.949 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 t -100.87 -39.89 7.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 122.362 1.077 . . . . 10.0 108.491 -174.275 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.0 m -101.09 -63.53 1.13 Allowed 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 128.003 2.521 . . . . 10.0 110.352 -177.709 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.4 m-70 -74.06 -29.15 61.75 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.483 1.29 . . . . 10.0 114.483 -168.693 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.1 m -54.8 -47.26 74.22 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.655 0.782 . . . . 10.0 110.881 178.59 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.4 ttt -116.26 -10.7 11.38 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.035 0.934 . . . . 10.0 112.526 -174.135 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.32 48.31 6.91 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 123.854 0.74 . . . . 10.0 112.85 -178.491 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 86.7 t -88.11 158.14 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 C-N-CA 125.438 1.495 . . . . 10.0 109.055 176.936 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.84 22.49 8.65 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.697 0.999 . . . . 10.0 113.697 -175.204 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.3 8.37 70.24 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 123.694 0.664 . . . . 10.0 113.332 -172.629 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.16 142.47 85.86 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 118.26 1.03 . . . . 10.0 111.713 -178.638 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' PRO . . . . . 0.448 ' HB2' ' HE2' ' A' ' 78' ' ' LYS . 83.4 Cg_endo -73.59 150.08 44.92 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.879 2.386 . . . . 10.0 111.092 -179.329 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.62 151.36 13.89 Favored 'General case' 0 C--O 1.245 0.851 0 CA-C-O 122.455 1.121 . . . . 10.0 112.482 -174.293 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.0 p -56.35 -34.35 66.53 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.104 2.562 . . . . 10.0 112.945 173.795 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -141.05 51.48 1.6 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.8 0.809 . . . . 10.0 112.41 177.275 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -69.64 161.62 29.31 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.133 -0.98 . . . . 10.0 109.948 170.592 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.4 t -107.86 -32.79 7.46 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.874 -0.516 . . . . 10.0 111.543 165.115 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.36 -24.78 39.57 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.42 -1.425 . . . . 10.0 113.587 -177.34 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.66 -18.98 39.12 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.745 1.618 . . . . 10.0 111.6 175.498 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -103.52 -34.19 8.76 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.744 1.618 . . . . 10.0 110.736 -176.853 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -43.29 -57.4 5.41 Favored Pre-proline 0 CA--C 1.545 0.786 0 CA-C-N 119.462 1.028 . . . . 10.0 113.637 170.991 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.12 3.53 3.94 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 122.187 1.925 . . . . 10.0 113.52 -179.308 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' ARG . . . . . 0.568 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 8.0 mmt85 -104.74 -47.89 3.93 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.765 1.626 . . . . 10.0 108.728 178.374 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.489 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -57.0 0.16 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.38 2.272 . . . . 10.0 114.246 168.122 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.69 -22.28 24.74 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.808 1.243 . . . . 10.0 110.484 175.678 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.9 mtmm -106.16 -63.45 1.26 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.565 0.746 . . . . 10.0 111.056 174.37 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.476 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 156.95 -165.31 33.12 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 111.363 -0.695 . . . . 10.0 111.363 -176.254 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -100.87 -41.77 9.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 124.329 1.052 . . . . 10.0 111.739 178.671 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.49 10.42 0.06 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.819 2.048 . . . . 10.0 114.694 -177.028 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.476 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -105.9 -58.06 1.96 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 126.192 1.797 . . . . 10.0 107.099 178.331 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.5 mt -72.46 -30.67 64.78 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.022 -0.99 . . . . 10.0 109.847 -174.392 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 p -60.99 -33.23 54.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-O 121.745 0.783 . . . . 10.0 110.879 171.863 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -69.73 -41.74 74.9 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.236 -0.915 . . . . 10.0 110.609 177.696 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.1 m -63.15 -36.0 82.16 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.458 -0.776 . . . . 10.0 110.317 174.294 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.5 t -60.52 -51.05 77.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 121.145 0.497 . . . . 10.0 111.647 179.375 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -33.61 72.39 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.078 0.466 . . . . 10.0 112.256 176.657 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.1 m -73.38 -33.07 64.84 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.822 0.849 . . . . 10.0 112.048 179.535 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.28 114.82 0.16 Allowed Glycine 0 CA--C 1.528 0.89 0 N-CA-C 111.195 -0.762 . . . . 10.0 111.195 -169.479 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.28 -157.33 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.145 0.978 . . . . 10.0 110.563 167.873 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -72.24 -63.35 1.16 Allowed 'General case' 0 N--CA 1.476 0.848 0 O-C-N 119.367 -2.083 . . . . 10.0 111.388 -175.167 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.72 -19.43 60.24 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.961 1.305 . . . . 10.0 111.742 176.608 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.1 ttp -97.43 120.35 61.03 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 123.405 0.682 . . . . 10.0 111.757 -173.216 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -69.42 155.69 66.35 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 121.715 1.61 . . . . 10.0 111.941 -173.273 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -63.95 117.82 4.8 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.997 2.465 . . . . 10.0 109.515 -177.564 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.08 30.48 9.32 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 120.997 -0.62 . . . . 10.0 112.78 -175.201 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 66.74 -63.53 0.18 Allowed Glycine 0 CA--C 1.534 1.252 0 C-N-CA 126.499 1.999 . . . . 10.0 114.665 174.161 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 5.8 ttp -171.84 -39.05 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.686 2.394 . . . . 10.0 110.685 171.82 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.51 -31.21 53.35 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 122.097 -0.377 . . . . 10.0 111.782 -178.604 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.8 m 72.76 -62.4 0.47 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.686 1.194 . . . . 10.0 112.592 -178.19 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -79.3 54.28 1.66 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.944 0.898 . . . . 10.0 110.579 -179.215 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.84 121.51 45.25 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.256 1.023 . . . . 10.0 109.718 -175.072 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 m -80.94 149.27 29.45 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.031 0.932 . . . . 10.0 110.53 -174.317 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -49.14 -40.21 31.76 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 120.121 1.328 . . . . 10.0 112.563 179.493 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -55.78 -38.8 70.39 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 113.521 0.934 . . . . 10.0 113.521 173.54 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -84.66 -38.27 20.01 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.876 1.27 . . . . 10.0 111.382 177.245 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -63.38 -55.1 27.21 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.376 -1.452 . . . . 10.0 111.426 178.157 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -48.99 74.43 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 107.573 -1.269 . . . . 10.0 107.573 -175.487 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.545 ' HB3' ' HB2' ' A' ' 3' ' ' ALA . . . -54.2 -31.52 53.21 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.367 0.506 . . . . 10.0 112.367 177.0 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.59 -50.14 53.94 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 119.206 0.912 . . . . 10.0 110.765 177.043 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 8.9 mt -60.54 -41.9 89.5 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.516 1.126 . . . . 10.0 111.701 176.232 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -65.41 -43.69 89.79 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.597 1.959 . . . . 10.0 112.374 175.138 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -55.61 -35.91 66.37 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.705 0.631 . . . . 10.0 112.705 174.501 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 56.2 mtm -76.61 -78.97 0.11 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.015 0.746 . . . . 10.0 113.015 179.787 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.4 t -151.62 37.06 0.58 Allowed 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.353 -0.842 . . . . 10.0 111.113 174.986 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 39.74 58.02 2.13 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.45 1.5 . . . . 10.0 113.5 172.923 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.568 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -155.02 -75.82 0.11 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.022 -0.99 . . . . 10.0 113.435 177.783 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.448 ' HE2' ' HB2' ' A' ' 23' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.245 0 C-N-CA 125.903 1.681 . . . . 10.0 112.978 -171.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.198 0 CA-C-O 119.228 -0.415 . . . . 10.0 110.641 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -159.83 125.86 4.26 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.404 1.082 . . . . 10.0 108.294 178.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . 0.411 HD13 ' N ' ' A' ' -1' ' ' LEU . 0.0 OUTLIER -109.11 58.11 0.61 Allowed 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 126.087 1.755 . . . . 10.0 109.164 178.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -95.44 -20.09 19.35 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.075 -0.966 . . . . 10.0 110.548 177.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -145.02 122.8 11.89 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.987 -0.745 . . . . 10.0 108.987 178.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -53.86 -39.14 65.41 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.12 0.968 . . . . 10.0 112.573 172.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -58.67 -47.42 84.53 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 110.277 -0.268 . . . . 10.0 110.277 171.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.34 -31.78 72.28 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.426 -0.796 . . . . 10.0 110.688 -177.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.5 mm -66.32 -50.98 63.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.201 0 CA-C-O 118.442 -0.789 . . . . 10.0 110.145 176.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.18 -43.13 78.85 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 117.891 -1.524 . . . . 10.0 111.233 178.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.96 -22.57 64.11 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.376 1.47 . . . . 10.0 112.593 -175.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.1 ttpt -91.35 -31.57 16.02 Favored 'General case' 0 CA--C 1.544 0.748 0 O-C-N 121.408 -0.807 . . . . 10.0 113.178 168.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.48 -65.93 1.11 Allowed 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.453 1.024 . . . . 10.0 112.506 -169.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -74.88 40.18 0.14 Allowed 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.088 1.355 . . . . 10.0 111.176 177.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.8 t -123.37 3.45 9.11 Favored 'General case' 0 N--CA 1.466 0.35 0 C-N-CA 125.252 1.421 . . . . 10.0 113.779 -165.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 40.8 t -105.98 -46.83 8.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 C-N-CA 124.234 1.013 . . . . 10.0 108.597 -174.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.6 m -91.01 -63.98 1.19 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 126.595 1.958 . . . . 10.0 111.471 177.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -73.32 -22.93 60.22 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.493 1.117 . . . . 10.0 113.977 -165.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.67 -53.74 54.82 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.157 0.983 . . . . 10.0 110.543 179.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 37.5 mmt -102.1 -23.8 14.02 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.402 1.081 . . . . 10.0 112.135 -179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.15 49.12 2.92 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 124.25 0.929 . . . . 10.0 112.04 -175.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 79.3 t -93.77 161.39 2.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 125.29 1.436 . . . . 10.0 109.397 179.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.07 18.9 6.76 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.456 1.102 . . . . 10.0 113.436 -174.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.3 18.43 76.23 Favored Glycine 0 CA--C 1.535 1.331 0 C-N-CA 124.566 1.079 . . . . 10.0 113.209 -173.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.56 145.53 90.19 Favored Pre-proline 0 CA--C 1.543 0.707 0 CA-C-N 118.525 1.162 . . . . 10.0 113.725 -172.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -76.88 137.21 17.47 Favored 'Trans proline' 0 N--CA 1.457 -0.642 0 C-N-CA 125.047 3.832 . . . . 10.0 110.02 -177.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.24 139.69 58.8 Favored 'General case' 0 C--O 1.24 0.56 0 C-N-CA 123.95 0.9 . . . . 10.0 112.567 -163.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 75.5 p -51.31 -32.53 25.51 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.508 1.123 . . . . 10.0 113.249 176.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.2 p80 -134.2 115.34 14.06 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.694 1.197 . . . . 10.0 109.369 171.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -154.58 166.18 34.14 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 125.521 1.528 . . . . 10.0 108.425 176.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 56.5 m -110.13 -36.01 5.95 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 117.776 0.262 . . . . 10.0 111.637 168.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.49 -21.41 35.52 Favored 'General case' 0 N--CA 1.469 0.504 0 O-C-N 121.305 -0.872 . . . . 10.0 113.268 -176.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 4.1 t0 -78.67 -30.56 46.25 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.769 2.028 . . . . 10.0 109.528 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 65.1 m95 -92.67 -35.42 13.51 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 126.546 1.939 . . . . 10.0 111.849 -179.412 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -43.18 -56.84 5.95 Favored Pre-proline 0 CA--C 1.549 0.94 0 N-CA-C 115.087 1.514 . . . . 10.0 115.087 175.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -67.95 -7.51 19.92 Favored 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 122.739 2.293 . . . . 10.0 113.413 -179.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -93.42 -51.62 4.89 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.684 1.194 . . . . 10.0 109.061 176.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.473 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.5 OUTLIER -61.77 8.78 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.868 1.667 . . . . 10.0 115.257 169.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.34 -37.92 14.53 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.977 0.911 . . . . 10.0 109.443 178.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -93.05 -38.72 11.48 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.01 0.924 . . . . 10.0 111.313 176.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 157.29 -143.56 9.69 Favored Glycine 0 CA--C 1.531 1.049 0 N-CA-C 111.325 -0.71 . . . . 10.0 111.325 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.9 t -127.04 -60.45 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.37 0 C-N-CA 123.734 0.814 . . . . 10.0 110.608 -176.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -44.96 -33.55 2.06 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.369 1.868 . . . . 10.0 113.653 176.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -48.34 -24.3 1.18 Allowed 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 125.101 1.36 . . . . 10.0 113.687 173.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -94.74 -47.04 6.65 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 125.431 1.492 . . . . 10.0 111.387 177.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.553 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.3 OUTLIER -51.96 -34.73 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.728 0 CA-C-N 119.434 1.015 . . . . 10.0 111.943 172.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -67.62 -44.01 79.03 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.525 -1.36 . . . . 10.0 112.627 169.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 43.5 m -64.08 -43.0 96.77 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.153 -0.967 . . . . 10.0 110.306 -177.028 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.553 HG12 ' HA ' ' A' ' 43' ' ' VAL . 7.6 p -65.64 -48.84 81.08 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 C-N-CA 124.268 1.027 . . . . 10.0 111.634 178.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.59 -31.93 72.83 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.471 0.653 . . . . 10.0 110.828 176.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 7.3 m -74.04 -33.91 63.9 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.464 -0.772 . . . . 10.0 112.445 176.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 89.01 113.89 1.31 Allowed Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.587 -1.005 . . . . 10.0 110.587 -169.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.29 -170.03 0.9 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.985 0.514 . . . . 10.0 109.873 165.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.407 ' H ' ' ND2' ' A' ' 51' ' ' ASN . 19.6 m-80 -66.58 -57.02 8.11 Favored 'General case' 0 N--CA 1.472 0.664 0 O-C-N 119.904 -1.747 . . . . 10.0 111.745 -172.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -80.68 1.69 28.99 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 113.76 -1.564 . . . . 10.0 112.397 176.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 43.4 mtp -109.67 140.73 22.46 Favored Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 112.788 0.662 . . . . 10.0 112.788 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -69.9 149.19 65.68 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.65 1.567 . . . . 10.0 110.679 174.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -65.58 104.91 0.7 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.38 2.72 . . . . 10.0 110.155 -179.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 110.7 22.44 6.35 Favored Glycine 0 CA--C 1.525 0.7 0 CA-C-O 118.813 -0.993 . . . . 10.0 113.093 -177.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 50.77 33.28 27.14 Favored Glycine 0 CA--C 1.535 1.286 0 CA-C-N 119.222 1.511 . . . . 10.0 114.477 177.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 6.0 ttm 60.2 29.87 19.37 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 125.866 1.667 . . . . 10.0 112.764 -176.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -114.6 -177.91 3.24 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 126.576 1.95 . . . . 10.0 110.171 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.5 t -145.99 -67.62 0.29 Allowed 'General case' 0 N--CA 1.473 0.691 0 O-C-N 121.582 -0.699 . . . . 10.0 110.72 178.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -105.41 31.22 5.08 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.671 1.188 . . . . 10.0 110.899 -176.113 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 64.8 m -88.92 114.07 25.15 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.768 1.227 . . . . 10.0 111.017 -172.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.4 p -86.3 151.18 23.8 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.433 0.693 . . . . 10.0 110.359 -174.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -47.79 -35.48 10.12 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 114.059 1.133 . . . . 10.0 114.059 -179.487 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -49.28 -55.76 11.67 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 118.537 0.608 . . . . 10.0 111.348 171.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -76.29 -37.01 58.08 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 121.543 -0.723 . . . . 10.0 110.928 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.2 -52.95 63.14 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 122.043 0.925 . . . . 10.0 111.115 -179.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.4 mmmm -64.87 -46.42 81.88 Favored 'General case' 0 C--O 1.225 -0.204 0 C-N-CA 124.961 1.305 . . . . 10.0 108.96 178.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.94 -34.85 60.82 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.528 0.566 . . . . 10.0 112.528 174.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.32 -43.5 70.16 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 120.644 -1.285 . . . . 10.0 111.279 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.23 -44.71 96.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 123.713 0.805 . . . . 10.0 112.051 169.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -76.1 -28.07 57.4 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.763 -1.211 . . . . 10.0 111.681 -175.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.5 t80 -46.87 -50.0 19.35 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.818 0.818 . . . . 10.0 110.716 170.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 72.2 mtm -68.46 -47.78 66.23 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.394 -0.821 . . . . 10.0 111.513 179.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.4 t -163.92 -87.41 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.353 0.661 . . . . 10.0 111.298 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.8 ptmt 172.43 53.15 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 126.825 2.05 . . . . 10.0 110.433 178.564 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.473 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -160.55 -85.27 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 114.025 1.12 . . . . 10.0 114.025 176.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.403 ' HA ' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.261 0 C-N-CA 125.612 1.565 . . . . 10.0 115.072 -173.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.747 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.041 0 CA-C-O 118.452 -0.785 . . . . 10.0 110.117 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -163.2 126.79 2.81 Favored 'General case' 0 N--CA 1.45 -0.454 0 O-C-N 123.847 0.717 . . . . 10.0 110.473 -179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -78.82 60.91 2.94 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.664 1.186 . . . . 10.0 109.984 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -111.95 -25.1 9.57 Favored 'General case' 0 C--N 1.331 -0.225 0 C-N-CA 125.95 1.7 . . . . 10.0 112.621 173.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -148.91 116.66 6.27 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-O 121.667 0.746 . . . . 10.0 110.207 176.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.41 -33.06 19.44 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 113.139 0.792 . . . . 10.0 113.139 171.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 18.0 tt0 -55.26 -50.61 69.03 Favored 'General case' 0 C--N 1.342 0.269 0 CA-C-N 118.29 0.496 . . . . 10.0 110.906 169.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.85 -34.21 75.08 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.296 0.638 . . . . 10.0 110.785 -177.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.2 mm -65.57 -51.84 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-O 118.47 -0.776 . . . . 10.0 109.381 176.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.403 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -68.35 -40.47 81.52 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 120.211 1.369 . . . . 10.0 111.249 -178.465 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -68.68 -22.25 64.38 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.461 1.504 . . . . 10.0 112.615 -178.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.49 -29.54 16.94 Favored 'General case' 0 CA--C 1.547 0.852 0 O-C-N 121.038 -1.039 . . . . 10.0 113.502 167.294 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -106.62 -66.34 1.02 Allowed 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.742 1.217 . . . . 10.0 112.442 -168.728 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.403 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -78.67 41.1 0.4 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 125.962 1.705 . . . . 10.0 109.771 179.582 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.8 t -123.21 4.09 9.21 Favored 'General case' 0 N--CA 1.461 0.084 0 C-N-CA 124.485 1.114 . . . . 10.0 112.997 -166.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.7 t -107.0 -53.68 6.43 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 C-N-CA 125.097 1.359 . . . . 10.0 108.676 -173.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.6 m -81.43 -62.18 1.73 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.609 1.163 . . . . 10.0 111.629 174.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 73.3 m-70 -73.59 -19.34 60.9 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.967 1.307 . . . . 10.0 114.097 -164.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.6 t -64.92 -46.5 81.4 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.731 0.812 . . . . 10.0 111.032 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.8 mmt -104.56 -27.28 11.97 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 125.277 1.431 . . . . 10.0 111.88 -179.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.38 52.8 1.8 Allowed Glycine 0 CA--C 1.533 1.174 0 C-N-CA 124.845 1.212 . . . . 10.0 112.156 -176.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 40.9 t -96.11 161.33 2.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.75 1.22 . . . . 10.0 109.786 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.23 16.89 5.25 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.083 1.353 . . . . 10.0 113.755 -176.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 74.95 25.52 69.05 Favored Glycine 0 CA--C 1.534 1.278 0 C-N-CA 123.858 0.742 . . . . 10.0 112.843 -172.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.25 141.56 91.53 Favored Pre-proline 0 CA--C 1.537 0.468 0 CA-C-N 118.384 1.092 . . . . 10.0 112.846 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_endo -68.66 145.24 62.97 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 124.08 3.186 . . . . 10.0 110.754 177.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.6 mtpt -73.75 143.39 46.11 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.116 0.413 . . . . 10.0 112.116 -168.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.9 p -57.37 -26.03 60.39 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.119 0.968 . . . . 10.0 113.222 175.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -132.91 105.73 7.28 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 124.139 0.976 . . . . 10.0 109.338 171.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 -147.09 157.98 43.79 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 106.898 -1.519 . . . . 10.0 106.898 173.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.1 t -104.31 -36.09 7.73 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 118.03 0.377 . . . . 10.0 110.876 166.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.03 -19.19 52.09 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 120.313 -1.492 . . . . 10.0 113.97 -176.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -89.75 -23.0 21.9 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.654 1.582 . . . . 10.0 110.398 179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.596 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 49.4 m95 -97.82 -32.51 11.67 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.834 1.254 . . . . 10.0 110.591 178.215 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.5 mt-10 -44.14 -58.17 5.25 Favored Pre-proline 0 CA--C 1.542 0.646 0 N-CA-C 114.615 1.339 . . . . 10.0 114.615 172.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.47 6.85 2.1 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 122.685 2.257 . . . . 10.0 113.612 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.0 mmt85 -110.8 -42.51 4.0 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.866 1.666 . . . . 10.0 108.777 178.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.18 2.18 1.26 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.465 1.906 . . . . 10.0 114.232 170.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -99.0 14.57 28.7 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.539 1.136 . . . . 10.0 110.61 177.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 24.9 mmtt -125.42 -61.96 1.24 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.104 1.362 . . . . 10.0 110.606 173.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.451 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 172.09 -125.44 1.18 Allowed Glycine 0 CA--C 1.53 0.994 0 N-CA-C 110.321 -1.111 . . . . 10.0 110.321 -177.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -146.81 -55.74 0.1 OUTLIER 'Isoleucine or valine' 0 C--O 1.235 0.299 0 C-N-CA 123.992 0.917 . . . . 10.0 110.6 -179.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.13 26.62 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 125.303 1.441 . . . . 10.0 113.995 179.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.451 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -102.78 -49.21 3.87 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 126.318 1.847 . . . . 10.0 107.208 177.527 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.6 mp -80.18 -35.05 36.96 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.63 -0.714 . . . . 10.0 110.634 -172.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.534 ' HA ' HG12 ' A' ' 46' ' ' VAL . 2.1 p -59.06 -23.76 25.24 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 C-N-CA 124.841 1.257 . . . . 10.0 112.362 171.113 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.3 mmtt -78.88 -44.89 21.84 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.359 -0.838 . . . . 10.0 111.321 171.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -63.22 -42.05 99.21 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 121.47 -0.769 . . . . 10.0 110.285 179.004 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.534 HG12 ' HA ' ' A' ' 43' ' ' VAL . 9.0 p -64.33 -48.2 86.37 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 C-N-CA 122.901 0.48 . . . . 10.0 110.845 -179.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.28 -33.96 76.64 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 120.981 0.42 . . . . 10.0 110.325 177.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 9.0 m -73.41 -28.94 62.27 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 112.867 0.691 . . . . 10.0 112.867 175.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.79 119.43 1.42 Allowed Glycine 0 CA--C 1.529 0.918 0 CA-C-N 119.271 0.941 . . . . 10.0 111.126 -172.412 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 4.8 tp -78.49 -146.09 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 123.918 0.887 . . . . 10.0 110.241 171.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -82.11 -64.06 1.26 Allowed 'General case' 0 N--CA 1.473 0.688 0 O-C-N 120.003 -1.686 . . . . 10.0 111.048 -175.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.84 -7.86 56.26 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.677 1.191 . . . . 10.0 112.521 174.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.5 mtp -97.05 135.34 22.02 Favored Pre-proline 0 CA--C 1.538 0.501 0 N-CA-C 113.073 0.768 . . . . 10.0 113.073 178.556 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.03 157.09 55.16 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 122.189 1.926 . . . . 10.0 110.635 175.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -65.54 101.83 0.46 Allowed 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 123.233 2.622 . . . . 10.0 109.989 -179.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 118.7 -0.15 15.51 Favored Glycine 0 CA--C 1.532 1.1 0 C-N-CA 123.681 0.658 . . . . 10.0 112.909 -172.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.409 ' O ' HMC2 ' A' ' 90' ' ' HEC . . . 75.71 -48.51 2.29 Favored Glycine 0 CA--C 1.537 1.446 0 CA-C-N 118.78 1.29 . . . . 10.0 112.667 -179.092 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -174.44 -37.21 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 126.995 2.118 . . . . 10.0 111.366 166.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.2 p -79.25 177.44 8.83 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 112.947 0.721 . . . . 10.0 112.947 -179.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 t -128.1 -60.67 1.13 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.998 1.319 . . . . 10.0 111.215 178.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -80.35 54.01 1.92 Allowed 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.586 1.154 . . . . 10.0 111.393 -177.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 18.8 m -110.03 125.72 53.22 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.452 1.501 . . . . 10.0 111.372 -177.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 30.2 m -112.89 137.13 51.72 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 124.86 1.264 . . . . 10.0 109.776 -177.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -35.31 -46.18 0.35 Allowed 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.775 2.03 . . . . 10.0 114.055 -178.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -28.92 -64.29 0.1 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.341 1.856 . . . . 10.0 112.733 165.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -90.17 -34.19 15.94 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.284 0.633 . . . . 10.0 111.724 177.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.58 -44.69 56.91 Favored 'General case' 0 CA--C 1.544 0.719 0 O-C-N 120.707 -1.246 . . . . 10.0 112.487 179.183 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.16 -48.17 53.37 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 123.639 0.776 . . . . 10.0 110.6 174.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.2 -30.6 7.19 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.473 0.545 . . . . 10.0 112.473 172.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -76.97 -34.36 57.58 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.539 1.136 . . . . 10.0 111.53 -178.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.423 HD11 HMB2 ' A' ' 90' ' ' HEC . 0.3 OUTLIER -75.0 -52.87 17.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.529 0 C-N-CA 124.519 1.128 . . . . 10.0 110.115 175.227 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -64.87 -25.71 68.01 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.513 0.725 . . . . 10.0 112.665 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 34.5 t80 -40.45 -48.08 2.71 Favored 'General case' 0 C--N 1.345 0.393 0 CA-C-O 121.75 0.786 . . . . 10.0 112.085 169.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.8 mpp? -74.68 -49.34 21.66 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.489 -0.778 . . . . 10.0 112.539 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.452 ' HB3' ' CE3' ' A' ' 31' ' ' TRP . 5.5 t -152.72 -89.91 0.05 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 118.787 -0.625 . . . . 10.0 110.208 175.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 169.17 54.96 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.812 1.645 . . . . 10.0 110.001 -176.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -167.22 -87.72 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.328 1.051 . . . . 10.0 113.08 173.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.596 ' HE3' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.285 -0.864 . . . . 10.0 112.414 -179.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.735 HMC1 ' CBC' ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.271 0 N-CA-C 114.394 1.257 . . . . 10.0 114.394 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -164.06 82.68 0.43 Allowed 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 119.255 0.934 . . . . 10.0 111.46 -173.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . 0.455 HD22 ' O ' ' A' ' -1' ' ' LEU . 0.0 OUTLIER -77.18 36.11 0.18 Allowed 'General case' 0 N--CA 1.472 0.664 0 N-CA-C 114.274 1.213 . . . . 10.0 114.274 -176.338 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -99.46 -26.41 14.13 Favored 'General case' 0 C--N 1.333 -0.127 0 O-C-N 121.676 -0.64 . . . . 10.0 112.028 178.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -139.66 120.36 14.29 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-O 121.533 0.683 . . . . 10.0 109.463 171.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -50.24 -36.32 30.6 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.723 0.809 . . . . 10.0 113.089 171.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -59.64 -45.67 91.31 Favored 'General case' 0 C--N 1.343 0.309 0 O-C-N 121.972 -0.455 . . . . 10.0 110.622 171.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.05 -31.97 72.0 Favored 'General case' 0 CA--C 1.53 0.185 0 O-C-N 121.53 -0.731 . . . . 10.0 111.05 179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.2 mm -65.32 -51.78 60.41 Favored 'Isoleucine or valine' 0 C--O 1.232 0.149 0 O-C-N 121.397 -0.814 . . . . 10.0 108.904 175.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.459 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.15 -42.28 76.18 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 117.87 -1.532 . . . . 10.0 111.905 -178.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.83 -22.0 64.26 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.466 1.506 . . . . 10.0 112.443 -177.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -92.04 -29.1 16.76 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 113.829 1.048 . . . . 10.0 113.829 168.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.91 -64.93 1.22 Allowed 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 124.218 1.007 . . . . 10.0 112.394 -170.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.459 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.56 40.63 0.18 Allowed 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 125.222 1.409 . . . . 10.0 111.232 178.429 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.4 t -126.9 -4.09 6.4 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 124.805 1.242 . . . . 10.0 114.101 -165.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.4 t -97.29 -40.58 10.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-O 122.456 1.122 . . . . 10.0 108.426 -175.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 74.3 m -104.06 -61.09 1.48 Allowed 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 126.765 2.026 . . . . 10.0 109.631 -173.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 68.5 m-70 -74.27 -16.7 60.94 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 114.537 1.31 . . . . 10.0 114.537 -169.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 5.0 m -69.81 -44.91 69.05 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 123.692 0.797 . . . . 10.0 110.893 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 tpt -115.05 -30.66 6.29 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.318 1.047 . . . . 10.0 113.039 -175.433 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.38 61.4 1.81 Allowed Glycine 0 CA--C 1.535 1.342 0 C-N-CA 125.533 1.539 . . . . 10.0 113.183 179.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 67.2 t -81.8 -57.13 5.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 O-C-N 121.951 -0.735 . . . . 10.0 112.056 -175.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.75 35.4 0.51 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 124.066 0.947 . . . . 10.0 110.725 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 58.64 27.35 61.24 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 124.686 1.136 . . . . 10.0 113.094 -173.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.52 138.19 96.77 Favored Pre-proline 0 CA--C 1.547 0.863 0 O-C-N 122.042 -0.681 . . . . 10.0 111.943 -177.024 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -68.67 149.7 73.81 Favored 'Trans proline' 0 N--CA 1.46 -0.464 0 C-N-CA 123.35 2.7 . . . . 10.0 111.025 -174.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 58.6 mttp -70.29 137.6 50.84 Favored 'General case' 0 CA--C 1.536 0.411 0 O-C-N 121.212 -0.93 . . . . 10.0 112.374 -161.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.4 m -51.53 -25.48 6.74 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 114.263 1.209 . . . . 10.0 114.263 172.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p-80 -142.5 91.14 2.29 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.637 0.775 . . . . 10.0 110.632 174.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -128.07 171.15 12.14 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.64 1.176 . . . . 10.0 109.166 170.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.6 m -105.36 -33.28 8.23 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 119.37 -0.348 . . . . 10.0 110.925 163.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.91 -38.66 61.77 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.904 -1.122 . . . . 10.0 113.852 -176.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 71.7 m-20 -66.79 -31.02 71.38 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-O 121.744 0.783 . . . . 10.0 110.072 177.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.458 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 64.4 m95 -91.79 -34.42 14.59 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 127.33 2.252 . . . . 10.0 111.982 -171.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -41.16 -61.98 1.17 Allowed Pre-proline 0 CA--C 1.546 0.816 0 N-CA-C 114.094 1.146 . . . . 10.0 114.094 175.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -71.26 8.79 1.02 Allowed 'Trans proline' 0 CA--C 1.541 0.863 0 C-N-CA 123.08 2.52 . . . . 10.0 114.006 -179.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.6 mmt85 -113.36 -51.45 2.81 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 126.019 1.728 . . . . 10.0 108.448 -178.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -21.8 66.65 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 126.601 1.96 . . . . 10.0 112.053 173.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -79.64 -27.96 40.9 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 124.153 0.981 . . . . 10.0 110.057 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 15.0 mmtt -76.41 -54.45 6.72 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 123.226 0.61 . . . . 10.0 109.936 174.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.48 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 162.5 -113.61 0.57 Allowed Glycine 0 CA--C 1.53 0.997 0 N-CA-C 111.167 -0.773 . . . . 10.0 111.167 176.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -144.09 -57.97 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.31 0 C-N-CA 124.201 1.0 . . . . 10.0 110.572 176.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -63.89 6.73 0.15 Allowed 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 126.007 1.723 . . . . 10.0 113.537 -174.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.48 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -93.34 -17.87 23.07 Favored 'General case' 0 C--N 1.341 0.203 0 C-N-CA 125.467 1.507 . . . . 10.0 110.702 -178.459 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -106.4 -40.78 5.49 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.907 0.883 . . . . 10.0 110.949 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.9 p -52.16 -35.0 18.54 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.673 0 CA-C-O 121.087 0.47 . . . . 10.0 110.532 170.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.6 ptmt -62.28 -46.36 89.14 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 113.815 1.043 . . . . 10.0 113.815 171.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 64.0 m -67.09 -32.56 73.79 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 120.886 -1.134 . . . . 10.0 110.287 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.3 t -58.15 -58.02 8.2 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 C-N-CA 122.839 0.456 . . . . 10.0 111.004 172.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -31.47 63.79 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 112.73 0.641 . . . . 10.0 112.73 175.892 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -71.71 -32.07 67.39 Favored 'General case' 0 N--CA 1.468 0.448 0 C-N-CA 122.848 0.459 . . . . 10.0 112.097 179.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 79.13 94.4 0.31 Allowed Glycine 0 CA--C 1.532 1.117 0 N-CA-C 111.473 -0.651 . . . . 10.0 111.473 -174.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.5 tp -63.17 168.85 3.89 Favored 'General case' 0 CA--C 1.537 0.474 0 O-C-N 121.854 -0.792 . . . . 10.0 111.355 175.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.519 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 6.6 m-80 -48.56 -57.64 5.88 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.953 -1.092 . . . . 10.0 113.043 -171.177 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.15 21.48 8.82 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 125.421 1.488 . . . . 10.0 112.473 174.66 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 39.3 ttp -126.71 129.64 24.02 Favored Pre-proline 0 CA--C 1.552 1.037 0 N-CA-C 114.313 1.227 . . . . 10.0 114.313 175.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -63.15 158.03 46.31 Favored 'Trans proline' 0 CA--C 1.539 0.755 0 C-N-CA 122.481 2.121 . . . . 10.0 112.155 177.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -58.96 135.71 68.5 Favored 'Trans proline' 0 N--CA 1.455 -0.793 0 C-N-CA 122.703 2.269 . . . . 10.0 110.263 -179.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.38 16.11 64.54 Favored Glycine 0 CA--C 1.527 0.841 0 O-C-N 121.742 -0.599 . . . . 10.0 113.872 -174.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 55.63 34.59 60.65 Favored Glycine 0 CA--C 1.534 1.263 0 CA-C-N 118.523 1.162 . . . . 10.0 112.285 -176.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 77.58 44.97 0.08 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 126.367 1.867 . . . . 10.0 112.529 -176.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.2 t -100.46 152.03 20.85 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.095 1.358 . . . . 10.0 110.901 171.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.5 p -108.78 -88.14 0.49 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.315 1.046 . . . . 10.0 110.132 164.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -106.14 74.93 1.07 Allowed 'General case' 0 N--CA 1.448 -0.573 0 C-N-CA 126.53 1.932 . . . . 10.0 108.1 -175.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -124.61 139.59 53.73 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.464 1.106 . . . . 10.0 110.514 174.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 93.6 m -111.43 153.16 26.51 Favored 'General case' 0 N--CA 1.466 0.349 0 C-N-CA 124.845 1.258 . . . . 10.0 110.148 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -34.45 -45.02 0.21 Allowed 'General case' 0 C--O 1.222 -0.373 0 C-N-CA 127.332 2.253 . . . . 10.0 114.54 176.272 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -41.19 -56.88 2.25 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 119.317 0.962 . . . . 10.0 113.518 170.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.12 -42.73 22.98 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.005 1.322 . . . . 10.0 112.739 175.699 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -55.25 -47.56 75.26 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.073 -1.017 . . . . 10.0 112.05 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.2 ptmm? -68.58 -52.21 34.24 Favored 'General case' 0 C--O 1.22 -0.451 0 N-CA-C 108.442 -0.948 . . . . 10.0 108.442 179.146 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.75 -34.55 39.88 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.119 0.567 . . . . 10.0 112.36 177.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -64.2 -50.14 69.26 Favored 'General case' 0 C--O 1.222 -0.347 0 C-N-CA 123.827 0.851 . . . . 10.0 109.811 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 8.9 mt -62.24 -44.15 98.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 124.181 0.993 . . . . 10.0 111.921 172.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -57.1 -37.92 72.62 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 125.303 1.441 . . . . 10.0 111.91 175.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -49.47 -43.41 45.04 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.476 0.547 . . . . 10.0 112.476 177.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.458 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -73.29 -69.83 0.4 Allowed 'General case' 0 CA--C 1.537 0.479 0 O-C-N 122.163 -0.336 . . . . 10.0 111.078 179.702 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 8.1 t -167.27 46.67 0.06 Allowed 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.625 0.77 . . . . 10.0 111.807 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 37.88 60.71 1.15 Allowed 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 125.471 1.508 . . . . 10.0 114.125 175.298 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -162.31 -82.0 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 113.232 0.827 . . . . 10.0 113.232 177.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.514 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.13 0 N-CA-C 114.74 1.385 . . . . 10.0 114.74 -173.149 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.87 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.992 0 CA-C-O 118.008 -0.996 . . . . 10.0 110.281 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -160.87 27.71 0.15 Allowed 'General case' 0 CA--C 1.548 0.89 0 CA-C-O 122.647 1.213 . . . . 10.0 110.475 176.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -93.15 62.65 3.56 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 107.955 -1.128 . . . . 10.0 107.955 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -111.8 -26.31 9.02 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 124.139 0.975 . . . . 10.0 113.514 173.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -151.49 115.16 4.88 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.526 0.731 . . . . 10.0 109.415 178.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -38.42 -43.77 0.86 Allowed 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 125.943 1.697 . . . . 10.0 113.749 167.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -60.84 -48.08 83.43 Favored 'General case' 0 C--N 1.341 0.217 0 CA-C-N 117.983 0.356 . . . . 10.0 111.1 173.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.61 -30.89 71.28 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.509 -0.744 . . . . 10.0 110.461 -179.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -65.63 -52.72 47.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 CA-C-O 118.916 -0.564 . . . . 10.0 109.534 176.185 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.15 -40.48 78.17 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 118.161 -1.416 . . . . 10.0 110.858 -179.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -68.66 -21.93 64.42 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.85 1.66 . . . . 10.0 112.738 -176.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.82 -27.25 14.01 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 113.447 0.906 . . . . 10.0 113.447 168.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -103.46 -67.73 0.87 Allowed 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.198 0.999 . . . . 10.0 112.409 -174.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -76.54 38.73 0.19 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.276 1.43 . . . . 10.0 111.001 179.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -120.39 -4.67 9.89 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 124.669 1.188 . . . . 10.0 113.782 -166.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 8.3 t -100.09 -40.95 8.81 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 124.346 1.058 . . . . 10.0 109.167 -169.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 19.2 m -99.46 -61.26 1.39 Allowed 'General case' 0 N--CA 1.449 -0.484 0 C-N-CA 127.292 2.237 . . . . 10.0 110.903 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 14.9 m-70 -73.44 -22.78 60.11 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.181 0.993 . . . . 10.0 113.542 -167.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.4 t -61.63 -52.48 64.17 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.573 0.749 . . . . 10.0 110.989 -178.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -101.42 -22.38 14.57 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.328 1.051 . . . . 10.0 111.775 -179.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.04 52.78 2.67 Favored Glycine 0 CA--C 1.534 1.229 0 C-N-CA 124.702 1.144 . . . . 10.0 111.956 -175.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 59.7 t -96.68 160.18 2.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 C-N-CA 125.262 1.425 . . . . 10.0 109.494 178.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 60.68 18.6 8.66 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.197 0.999 . . . . 10.0 113.486 -176.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 82.12 3.89 90.42 Favored Glycine 0 CA--C 1.537 1.449 0 C-N-CA 124.082 0.849 . . . . 10.0 113.444 -173.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.49 146.28 64.86 Favored Pre-proline 0 CA--C 1.538 0.489 0 CA-C-N 118.164 0.982 . . . . 10.0 113.394 -174.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -70.5 155.33 63.71 Favored 'Trans proline' 0 N--CA 1.454 -0.814 0 C-N-CA 123.73 2.954 . . . . 10.0 109.723 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 46.8 mttp -68.95 139.68 55.06 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 119.825 -0.75 . . . . 10.0 111.573 -176.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 47.2 t -32.24 -45.34 0.11 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 126.848 2.059 . . . . 10.0 113.45 169.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.1 p80 -139.28 102.14 4.42 Favored 'General case' 0 CA--C 1.54 0.573 0 C-N-CA 124.004 0.922 . . . . 10.0 109.191 170.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -118.03 157.92 25.93 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 107.059 -1.46 . . . . 10.0 107.059 170.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 92.9 m -103.79 -35.49 8.18 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.519 0.6 . . . . 10.0 111.279 171.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.82 -23.64 36.35 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.102 -0.999 . . . . 10.0 113.269 -178.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.435 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 33.0 t0 -87.62 -22.3 24.82 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 126.072 1.749 . . . . 10.0 110.517 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.448 ' CZ3' ' HB2' ' A' ' 74' ' ' MET . 36.7 m95 -95.39 -35.59 11.68 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 126.06 1.744 . . . . 10.0 110.803 177.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -40.14 -59.54 1.8 Allowed Pre-proline 0 N--CA 1.476 0.825 0 N-CA-C 114.248 1.203 . . . . 10.0 114.248 170.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -72.05 17.51 0.33 Allowed 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 123.379 2.719 . . . . 10.0 113.925 -179.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.83 -43.49 2.36 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.426 1.89 . . . . 10.0 110.336 168.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.1 -13.02 5.73 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.536 1.934 . . . . 10.0 112.488 174.052 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -84.93 -30.62 24.18 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.586 1.155 . . . . 10.0 110.513 176.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 39.5 mtpt -77.01 -52.21 9.74 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.144 -0.688 . . . . 10.0 109.144 176.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.474 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 157.66 -116.61 0.73 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.545 1.069 . . . . 10.0 110.594 175.275 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.405 ' C ' ' H ' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -149.02 -55.82 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.34 0 C-N-CA 124.314 1.046 . . . . 10.0 110.331 174.63 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.442 ' HA ' HG12 ' A' ' 43' ' ' VAL . 0.8 OUTLIER -71.76 28.88 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 124.265 1.026 . . . . 10.0 113.515 -177.113 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.474 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -101.53 -56.3 2.33 Favored 'General case' 0 C--N 1.339 0.133 0 C-N-CA 128.053 2.541 . . . . 10.0 107.217 176.607 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.668 ' HB3' HMA2 ' A' ' 90' ' ' HEC . 0.8 OUTLIER -82.65 -26.41 32.18 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 118.71 -0.662 . . . . 10.0 111.161 -172.725 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.461 HG23 HD13 ' A' ' 71' ' ' ILE . 1.2 p -57.17 -22.6 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 125.578 1.551 . . . . 10.0 111.767 166.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.9 mmpt? -80.62 -38.27 29.56 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.227 0.611 . . . . 10.0 111.728 169.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -73.84 -37.7 64.75 Favored 'General case' 0 N--CA 1.465 0.322 0 O-C-N 120.471 -1.393 . . . . 10.0 110.874 -176.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.442 HG12 ' HA ' ' A' ' 43' ' ' VAL . 10.7 p -61.79 -42.46 94.56 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 C-N-CA 124.246 1.018 . . . . 10.0 110.544 173.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.17 -35.81 76.71 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-O 121.143 0.497 . . . . 10.0 109.683 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 28.0 m -73.05 -34.34 66.22 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.153 -0.967 . . . . 10.0 111.88 177.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.54 115.65 3.72 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.457 -1.057 . . . . 10.0 110.457 -168.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -78.02 -152.9 0.06 Allowed 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 109.015 -0.735 . . . . 10.0 109.015 167.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -81.51 -60.69 2.17 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.652 -1.28 . . . . 10.0 110.428 -179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.09 -7.21 59.2 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 125.448 1.499 . . . . 10.0 112.335 177.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.72 142.59 25.3 Favored Pre-proline 0 N--CA 1.468 0.442 0 N-CA-C 112.236 0.458 . . . . 10.0 112.236 177.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -68.66 148.0 71.04 Favored 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 122.376 2.051 . . . . 10.0 110.753 175.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.9 Cg_endo -66.67 110.22 1.83 Allowed 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 123.216 2.611 . . . . 10.0 109.825 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 91.52 35.9 6.74 Favored Glycine 0 C--N 1.338 0.688 0 CA-C-O 119.617 -0.546 . . . . 10.0 111.872 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 28.94 39.38 0.02 OUTLIER Glycine 0 CA--C 1.535 1.33 0 C-N-CA 127.365 2.412 . . . . 10.0 115.661 -172.049 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 62.83 -0.85 0.52 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.844 2.057 . . . . 10.0 115.793 -174.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 2.6 p -94.02 -29.07 15.4 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 124.608 1.163 . . . . 10.0 112.541 177.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 96.7 m 65.54 -71.34 0.08 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.149 1.38 . . . . 10.0 111.97 -178.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -79.63 54.52 1.81 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.22 1.408 . . . . 10.0 109.962 179.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -94.0 117.28 29.89 Favored 'General case' 0 C--O 1.232 0.134 0 C-N-CA 124.637 1.175 . . . . 10.0 109.307 -174.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 90.9 m -116.34 129.1 56.08 Favored 'General case' 0 C--O 1.234 0.26 0 N-CA-C 108.029 -1.101 . . . . 10.0 108.029 -174.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -37.39 -41.45 0.43 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.93 1.692 . . . . 10.0 112.533 179.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -35.42 -57.36 0.61 Allowed 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 114.245 1.202 . . . . 10.0 114.245 169.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -91.94 -34.98 14.26 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.188 0.904 . . . . 10.0 111.25 173.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.95 -42.2 85.66 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 120.5 -1.375 . . . . 10.0 112.559 -170.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.01 -42.73 99.9 Favored 'General case' 0 C--O 1.222 -0.35 0 O-C-N 121.353 -0.842 . . . . 10.0 109.909 174.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -65.39 -28.8 69.52 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.351 1.06 . . . . 10.0 111.999 176.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -74.64 -46.38 38.58 Favored 'General case' 0 C--O 1.223 -0.341 0 O-C-N 121.007 -1.058 . . . . 10.0 109.604 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.461 HD13 HG23 ' A' ' 43' ' ' VAL . 0.9 OUTLIER -61.45 -46.65 96.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 CA-C-O 121.514 0.673 . . . . 10.0 111.407 170.667 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . 0.256 0.0 OUTLIER -59.63 -35.38 74.26 Favored 'General case' 0 C--O 1.232 0.147 0 O-C-N 121.491 -0.756 . . . . 10.0 112.185 -177.866 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 53.2 t80 -44.61 -41.14 6.36 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.34 0.867 . . . . 10.0 113.34 178.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.448 ' HB2' ' CZ3' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -76.72 -67.5 0.69 Allowed 'General case' 0 CA--C 1.538 0.497 0 O-C-N 122.113 -0.367 . . . . 10.0 111.713 -177.323 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.0 t -164.07 33.81 0.08 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 123.696 0.798 . . . . 10.0 112.479 179.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.9 ptmt 38.23 61.27 1.14 Allowed 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.863 1.265 . . . . 10.0 114.172 176.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -149.49 -55.57 0.18 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.073 0.949 . . . . 10.0 112.806 -178.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.642 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.2 0 C-N-CA 125.97 1.708 . . . . 10.0 112.134 -171.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.837 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.017 0 CA-C-O 117.399 -1.286 . . . . 10.0 109.359 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -161.38 91.52 0.85 Allowed 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 108.605 -0.887 . . . . 10.0 108.605 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . 0.428 HD22 ' O ' ' A' ' -1' ' ' LEU . 0.0 OUTLIER -144.68 30.74 1.19 Allowed 'General case' 0 C--O 1.223 -0.333 0 N-CA-C 113.34 0.867 . . . . 10.0 113.34 -174.872 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -96.85 -21.42 17.51 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.619 0.768 . . . . 10.0 112.14 -172.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -139.87 121.53 15.3 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 124.697 1.199 . . . . 10.0 107.996 172.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -44.84 -41.0 6.68 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.114 1.366 . . . . 10.0 113.363 168.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 68.4 tt0 -59.51 -47.27 86.15 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.053 -0.405 . . . . 10.0 110.901 171.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.17 -31.3 70.76 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.705 -0.622 . . . . 10.0 111.123 -178.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 24.3 mt -64.44 -53.12 46.66 Favored 'Isoleucine or valine' 0 C--N 1.338 0.076 0 N-CA-C 107.981 -1.118 . . . . 10.0 107.981 176.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.43 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.3 OUTLIER -69.69 -41.58 75.24 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 117.836 -1.545 . . . . 10.0 112.085 -177.427 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.1 t30 -68.78 -21.8 64.32 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 126.299 1.839 . . . . 10.0 112.566 -177.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.65 -28.56 15.29 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 113.291 0.848 . . . . 10.0 113.291 168.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -108.05 -64.67 1.19 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.173 0.989 . . . . 10.0 112.652 -170.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.1 41.74 0.3 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.911 1.285 . . . . 10.0 110.552 178.302 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.2 t -126.82 4.04 6.65 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.556 1.142 . . . . 10.0 113.507 -165.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.9 t -109.75 -53.76 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 C-N-CA 125.175 1.39 . . . . 10.0 108.676 -172.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.9 m -79.31 -64.31 1.22 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.856 1.262 . . . . 10.0 110.422 173.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -73.81 -10.39 59.62 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.152 1.781 . . . . 10.0 115.058 -165.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.9 t -72.01 -48.18 46.57 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.92 0.488 . . . . 10.0 109.968 178.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.3 tpt -106.59 -41.07 5.36 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 124.155 0.982 . . . . 10.0 112.439 -179.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 96.25 62.47 0.96 Allowed Glycine 0 CA--C 1.536 1.376 0 C-N-CA 125.495 1.522 . . . . 10.0 112.666 -175.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 95.3 t -82.41 -55.99 6.72 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 O-C-N 121.854 -0.792 . . . . 10.0 112.027 -176.373 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.94 32.92 0.43 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.064 0.946 . . . . 10.0 111.079 177.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 66.33 16.66 65.21 Favored Glycine 0 CA--C 1.536 1.385 0 C-N-CA 124.635 1.112 . . . . 10.0 113.442 -173.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.29 141.46 96.23 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 113.4 0.889 . . . . 10.0 113.4 -174.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -69.58 138.56 38.68 Favored 'Trans proline' 0 N--CA 1.461 -0.432 0 C-N-CA 124.764 3.642 . . . . 10.0 110.717 -176.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 16.4 mttm -69.32 138.54 53.86 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 121.715 -0.616 . . . . 10.0 111.157 -168.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.6 t -47.46 -36.95 10.8 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 113.076 0.769 . . . . 10.0 113.076 175.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -119.8 73.72 0.98 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.646 1.578 . . . . 10.0 111.889 179.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 -117.74 159.8 22.4 Favored 'General case' 0 CA--C 1.539 0.536 0 O-C-N 121.046 -1.034 . . . . 10.0 109.757 171.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 57.6 m -108.33 -35.9 6.4 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 122.5 0.32 . . . . 10.0 111.39 172.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.01 -23.32 31.01 Favored 'General case' 0 N--CA 1.466 0.357 0 O-C-N 121.699 -0.625 . . . . 10.0 112.363 -176.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -80.19 -33.86 37.88 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.859 1.663 . . . . 10.0 109.769 178.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.529 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 58.4 m95 -86.41 -35.33 19.8 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 126.039 1.736 . . . . 10.0 111.772 178.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -39.61 -59.69 1.56 Allowed Pre-proline 0 CA--C 1.548 0.887 0 O-C-N 120.272 -1.518 . . . . 10.0 114.762 172.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -75.06 15.46 0.74 Allowed 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.617 2.878 . . . . 10.0 113.528 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.615 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -116.57 -45.45 2.8 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.531 1.932 . . . . 10.0 108.176 177.609 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.414 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 1.3 mt -58.18 0.35 0.07 Allowed 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 127.623 2.369 . . . . 10.0 114.208 168.063 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -84.04 -29.12 27.14 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.218 1.407 . . . . 10.0 110.076 177.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 60.1 mttm -94.61 -64.68 1.05 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.865 0.866 . . . . 10.0 109.359 -179.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.486 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 129.51 119.97 2.2 Favored Glycine 0 CA--C 1.531 1.054 0 C-N-CA 124.184 0.897 . . . . 10.0 112.127 171.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.6 m -38.59 116.06 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 114.214 1.19 . . . . 10.0 114.214 -178.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 30.3 m-20 138.23 -19.99 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 130.142 3.377 . . . . 10.0 110.819 -169.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.486 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -78.09 -57.51 3.75 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.436 1.017 . . . . 10.0 109.985 172.236 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.528 ' HB3' HMA2 ' A' ' 90' ' ' HEC . 4.2 mp -76.7 -24.06 53.12 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.52 -0.737 . . . . 10.0 111.76 -168.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -60.15 -27.37 38.99 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 O-C-N 121.686 -0.634 . . . . 10.0 110.829 170.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.9 mmpt? -67.53 -45.84 74.56 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.347 -0.845 . . . . 10.0 110.761 171.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 14.9 m -62.08 -36.57 82.08 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 121.174 -0.953 . . . . 10.0 110.155 177.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.2 t -58.84 -54.13 37.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-O 121.065 0.46 . . . . 10.0 111.177 175.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -33.92 71.67 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 112.325 0.491 . . . . 10.0 112.325 178.075 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 58.7 m -71.56 -27.48 63.19 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.696 0.799 . . . . 10.0 112.852 179.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 76.67 91.93 0.23 Allowed Glycine 0 CA--C 1.53 0.985 0 CA-C-N 119.336 0.971 . . . . 10.0 112.27 -174.19 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.94 167.99 1.43 Allowed 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 122.056 0.932 . . . . 10.0 111.419 171.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.508 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 13.7 m-80 -53.66 -55.3 27.21 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 120.515 -1.365 . . . . 10.0 112.417 -172.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.15 19.93 2.94 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 113.862 -1.517 . . . . 10.0 112.573 174.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 4.0 ttp -136.15 134.94 20.49 Favored Pre-proline 0 CA--C 1.546 0.802 0 N-CA-C 114.769 1.396 . . . . 10.0 114.769 -175.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -68.14 147.66 73.48 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 120.965 1.11 . . . . 10.0 111.553 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -61.5 132.61 41.51 Favored 'Trans proline' 0 N--CA 1.459 -0.536 0 C-N-CA 123.251 2.634 . . . . 10.0 109.853 178.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.65 15.05 81.88 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 119.711 -1.233 . . . . 10.0 112.76 -172.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.09 34.63 6.03 Favored Glycine 0 CA--C 1.535 1.335 0 CA-C-N 118.36 1.08 . . . . 10.0 113.728 -177.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 77.18 37.92 0.25 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 126.231 1.812 . . . . 10.0 113.583 -177.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 9.8 t -126.03 164.6 20.5 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.427 1.491 . . . . 10.0 111.65 169.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 53.0 m -102.88 -64.06 1.11 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.686 1.194 . . . . 10.0 111.62 -178.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -122.56 46.51 2.13 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.893 1.277 . . . . 10.0 110.536 -176.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 5.4 m -71.98 116.02 11.88 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 120.824 -1.173 . . . . 10.0 110.068 172.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.2 t -85.08 138.85 32.16 Favored 'General case' 0 C--O 1.231 0.123 0 C-N-CA 123.284 0.634 . . . . 10.0 109.612 172.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -36.73 -40.09 0.25 Allowed 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 126.49 1.916 . . . . 10.0 112.46 174.045 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -42.17 -55.17 3.37 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.912 1.285 . . . . 10.0 114.049 170.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -89.45 -33.85 16.67 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.065 0.546 . . . . 10.0 111.278 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -52.67 -43.79 65.77 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.417 1.087 . . . . 10.0 111.417 176.672 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 27.7 pttt -72.45 -45.15 60.88 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.86 1.264 . . . . 10.0 110.159 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -57.68 -33.5 68.41 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.432 -0.793 . . . . 10.0 111.577 174.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.56 -46.66 84.88 Favored 'General case' 0 C--O 1.225 -0.211 0 C-N-CA 124.039 0.935 . . . . 10.0 110.561 -176.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 25.0 pt -76.59 -37.99 30.45 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 C-N-CA 124.061 0.945 . . . . 10.0 112.28 174.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -58.19 -36.74 73.52 Favored 'General case' 0 N--CA 1.465 0.32 0 O-C-N 121.893 -0.504 . . . . 10.0 112.345 173.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 22.0 t80 -51.08 -44.96 61.3 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 112.428 0.529 . . . . 10.0 112.428 174.321 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -67.62 -75.01 0.1 Allowed 'General case' 0 CA--C 1.538 0.492 0 N-CA-C 112.618 0.599 . . . . 10.0 112.618 -176.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -153.75 25.51 0.5 Allowed 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.11 0.564 . . . . 10.0 111.769 -179.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 34.39 61.35 0.55 Allowed 'General case' 0 C--N 1.339 0.143 0 C-N-CA 126.895 2.078 . . . . 10.0 115.696 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.615 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -142.84 -56.76 0.43 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 115.311 -0.858 . . . . 10.0 112.676 -176.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.789 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.954 0 CA-C-O 116.624 -1.655 . . . . 10.0 112.823 -177.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.789 HMA3 ' HB2' ' A' ' 78' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.095 0 CA-C-O 117.145 -1.407 . . . . 10.0 109.271 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -164.09 128.39 2.71 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.91 1.684 . . . . 10.0 108.082 165.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -139.74 29.89 2.1 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 113.196 0.813 . . . . 10.0 113.196 165.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -96.83 -20.03 18.46 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.817 0.673 . . . . 10.0 112.817 -167.315 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -141.17 131.2 24.61 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 108.159 -1.052 . . . . 10.0 108.159 166.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -46.29 -40.52 11.76 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.877 1.271 . . . . 10.0 112.783 169.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -56.24 -50.53 71.05 Favored 'General case' 0 N--CA 1.455 -0.194 0 C-N-CA 122.684 0.394 . . . . 10.0 111.008 171.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.15 -32.25 72.4 Favored 'General case' 0 CA--C 1.529 0.17 0 O-C-N 121.906 -0.496 . . . . 10.0 110.788 -176.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 27.1 mt -64.69 -52.66 51.82 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 N-CA-C 108.566 -0.901 . . . . 10.0 108.566 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.479 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.07 -41.58 77.35 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 117.882 -1.527 . . . . 10.0 112.033 -178.419 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -68.91 -22.13 64.18 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.757 1.623 . . . . 10.0 112.608 -176.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.0 tttp -95.77 -28.13 14.91 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.976 0.91 . . . . 10.0 113.35 170.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.403 ' O ' HMC3 ' A' ' 90' ' ' HEC . . . -109.5 -65.03 1.18 Allowed 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 124.287 1.035 . . . . 10.0 112.318 -171.731 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.479 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.82 41.43 0.21 Allowed 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 125.16 1.384 . . . . 10.0 111.013 178.118 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -125.41 -2.38 7.46 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 114.173 1.175 . . . . 10.0 114.173 -164.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 46.9 t -99.46 -47.99 11.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 C-N-CA 124.574 1.15 . . . . 10.0 108.48 -177.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 89.9 m -95.48 -59.43 1.88 Allowed 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.696 1.998 . . . . 10.0 110.602 -173.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 -74.44 -17.98 60.7 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 -171.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.2 t -62.84 -49.91 73.01 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 122.99 0.516 . . . . 10.0 110.465 -178.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.3 tpt -102.84 -33.78 9.23 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.633 0.773 . . . . 10.0 112.705 176.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 101.45 56.52 0.86 Allowed Glycine 0 CA--C 1.536 1.382 0 C-N-CA 125.078 1.323 . . . . 10.0 111.572 -170.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 82.4 t -98.97 157.74 3.65 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.631 1.572 . . . . 10.0 109.703 179.339 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.15 24.24 11.09 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 124.448 1.099 . . . . 10.0 112.894 -175.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.18 5.47 87.3 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.124 0.868 . . . . 10.0 113.497 -174.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -58.87 145.83 77.86 Favored Pre-proline 0 CA--C 1.538 0.484 0 CA-C-N 118.771 1.286 . . . . 10.0 112.545 -178.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 62.0 Cg_endo -66.11 163.18 32.49 Favored 'Trans proline' 0 N--CA 1.452 -0.918 0 C-N-CA 123.599 2.866 . . . . 10.0 109.192 171.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.0 tttp -84.31 149.24 26.2 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 121.624 0.726 . . . . 10.0 110.908 -178.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.7 p -43.28 -70.02 0.12 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.173 1.789 . . . . 10.0 111.4 170.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -103.48 119.98 39.94 Favored 'General case' 0 N--CA 1.446 -0.666 0 C-N-CA 125.823 1.649 . . . . 10.0 108.133 174.085 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -151.76 167.74 27.28 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 126.24 1.816 . . . . 10.0 108.19 171.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 50.0 m -110.77 -36.21 5.77 Favored 'General case' 0 N--CA 1.468 0.462 0 N-CA-C 111.856 0.317 . . . . 10.0 111.856 170.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.36 -14.03 41.85 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.288 -0.883 . . . . 10.0 113.159 -177.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -87.25 -27.21 23.07 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 126.515 1.926 . . . . 10.0 110.191 176.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 83.9 m95 -95.66 -38.84 10.19 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.367 1.867 . . . . 10.0 112.017 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -41.7 -57.86 3.62 Favored Pre-proline 0 CA--C 1.547 0.852 0 N-CA-C 114.682 1.364 . . . . 10.0 114.682 173.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.12 1.16 4.24 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 123.331 2.687 . . . . 10.0 113.949 -179.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -102.93 -43.66 5.46 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.12 1.368 . . . . 10.0 109.237 177.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -59.5 5.31 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.107 1.763 . . . . 10.0 114.757 165.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.14 -30.69 18.42 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.59 1.156 . . . . 10.0 110.32 176.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 5.7 mtmp? -91.34 -54.66 3.83 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.121 0.568 . . . . 10.0 111.218 174.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.479 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 161.34 -123.14 1.18 Allowed Glycine 0 CA--C 1.533 1.186 0 N-CA-C 111.782 -0.527 . . . . 10.0 111.782 178.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.4 -65.54 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.411 0 C-N-CA 124.271 1.029 . . . . 10.0 111.75 -177.447 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.7 15.86 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.871 1.668 . . . . 10.0 115.304 -179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.479 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.3 OUTLIER -93.03 -48.74 6.36 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 125.401 1.48 . . . . 10.0 108.661 178.152 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.6 mt -81.03 -33.43 33.57 Favored 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 124.325 1.05 . . . . 10.0 110.13 -168.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.4 p -54.59 -32.43 25.14 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 CA-C-O 121.651 0.738 . . . . 10.0 111.627 169.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -64.85 -41.71 95.49 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.645 -0.659 . . . . 10.0 110.892 177.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.0 m -67.69 -34.31 76.65 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 121.52 -0.738 . . . . 10.0 110.338 174.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 8.0 t -58.38 -52.51 58.28 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 O-C-N 121.791 -0.568 . . . . 10.0 111.173 175.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.6 -37.45 70.68 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.187 0.44 . . . . 10.0 112.187 174.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -71.87 -33.66 68.57 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.218 0.607 . . . . 10.0 111.972 -177.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.9 97.54 0.25 Allowed Glycine 0 CA--C 1.535 1.285 0 N-CA-C 111.482 -0.647 . . . . 10.0 111.482 -169.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.8 tt -61.54 167.3 3.51 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.845 -0.797 . . . . 10.0 111.197 173.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.513 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 5.1 m-80 -45.51 -58.89 3.04 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 120.553 -1.342 . . . . 10.0 113.545 -172.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -93.98 19.36 9.16 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.312 1.445 . . . . 10.0 112.859 175.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 34.9 ttp -125.23 129.09 24.6 Favored Pre-proline 0 CA--C 1.553 1.084 0 N-CA-C 114.116 1.154 . . . . 10.0 114.116 173.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -63.06 158.29 44.52 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 122.229 1.953 . . . . 10.0 111.864 176.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -60.3 148.16 91.13 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.792 2.328 . . . . 10.0 111.021 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 53.12 31.57 41.21 Favored Glycine 0 CA--C 1.528 0.856 0 CA-C-N 115.916 -0.583 . . . . 10.0 113.598 -174.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 42.42 32.45 1.21 Allowed Glycine 0 CA--C 1.543 1.813 0 C-N-CA 124.554 1.073 . . . . 10.0 114.534 -170.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.3 ttm 81.24 27.09 0.2 Allowed 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.068 2.147 . . . . 10.0 114.896 -176.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 8.7 t -104.76 165.63 10.94 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 120.857 -1.152 . . . . 10.0 112.172 171.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 29.4 m -100.71 -91.94 0.3 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.788 1.235 . . . . 10.0 109.682 174.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -92.57 46.53 1.25 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.441 1.096 . . . . 10.0 110.7 -173.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -76.61 115.89 16.78 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 120.692 -1.255 . . . . 10.0 109.943 175.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 93.7 m -80.16 149.82 30.39 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.514 0.725 . . . . 10.0 109.596 174.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -32.77 -55.74 0.37 Allowed 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.123 1.157 . . . . 10.0 114.123 167.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -48.22 -55.47 10.4 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.501 0.72 . . . . 10.0 111.675 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -73.57 -35.68 65.49 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.854 -0.529 . . . . 10.0 111.473 -177.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -56.94 -50.69 71.83 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 121.751 0.786 . . . . 10.0 110.987 172.104 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 28.9 mttt -64.58 -50.59 66.64 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.434 1.494 . . . . 10.0 109.544 -177.036 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.64 -39.67 25.02 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.033 0.533 . . . . 10.0 112.022 169.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.09 -47.71 60.75 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 120.862 -1.149 . . . . 10.0 112.186 177.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.4 mt -55.94 -48.99 77.8 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 C-N-CA 124.85 1.26 . . . . 10.0 111.431 174.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.06 -24.97 58.29 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 120.94 -1.1 . . . . 10.0 113.195 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 22.3 t80 -47.03 -50.63 19.12 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 119.152 0.887 . . . . 10.0 111.295 170.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -70.61 -44.33 67.48 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 178.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -154.2 -77.32 0.11 Allowed 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.928 -0.558 . . . . 10.0 112.35 172.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 157.99 58.22 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 128.697 2.799 . . . . 10.0 111.215 -175.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -174.14 -75.96 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 114.809 1.411 . . . . 10.0 114.809 172.226 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.448 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 7.9 pttp . . . . . 0 C--O 1.256 1.415 0 N-CA-C 115.603 1.705 . . . . 10.0 115.603 -174.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.865 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 118.746 -0.645 . . . . 10.0 110.942 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -161.03 125.73 3.58 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.902 0.881 . . . . 10.0 110.214 -175.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.85 65.14 1.35 Allowed 'General case' 0 CA--C 1.533 0.308 0 CA-C-O 122.168 0.985 . . . . 10.0 111.79 176.021 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.35 -24.14 12.34 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 112.93 0.715 . . . . 10.0 112.93 -178.438 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 53.4 t0 -142.05 124.29 15.54 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 107.302 -1.37 . . . . 10.0 107.302 171.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.407 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . . . -50.98 -37.26 43.62 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 113.987 1.106 . . . . 10.0 113.987 172.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -55.75 -49.57 72.74 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 118.648 0.658 . . . . 10.0 109.864 172.42 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.64 -33.71 74.48 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 122.866 0.466 . . . . 10.0 111.106 -179.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.91 -51.31 62.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 107.929 -1.137 . . . . 10.0 107.929 179.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.411 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -68.93 -42.1 77.22 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 119.615 1.098 . . . . 10.0 111.187 -178.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -68.26 -22.23 64.77 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.906 1.282 . . . . 10.0 112.639 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.9 tppt? -93.68 -28.17 16.13 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.485 1.114 . . . . 10.0 113.647 169.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -108.71 -68.87 0.89 Allowed 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.387 1.475 . . . . 10.0 112.777 -171.079 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.411 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.54 45.05 0.38 Allowed 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 125.393 1.477 . . . . 10.0 109.683 179.079 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.9 t -128.7 -5.5 5.18 Favored 'General case' 0 CA--C 1.521 -0.139 0 C-N-CA 125.388 1.475 . . . . 10.0 113.343 -167.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.1 t -101.91 -34.19 3.68 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 125.269 1.427 . . . . 10.0 109.171 -173.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.2 m -102.57 -63.31 1.17 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.101 2.16 . . . . 10.0 110.947 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 76.7 m-70 -73.41 -24.9 60.33 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 114.062 1.134 . . . . 10.0 114.062 -162.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 31.0 t -58.59 -50.79 72.52 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 124.281 1.032 . . . . 10.0 111.339 179.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.6 tpt -105.07 -17.9 14.34 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 123.661 0.784 . . . . 10.0 112.073 -178.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.01 50.17 4.0 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 124.191 0.901 . . . . 10.0 112.17 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 47.0 t -95.51 162.17 2.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 C-N-CA 125.344 1.458 . . . . 10.0 109.616 179.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.84 19.29 8.18 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.632 1.173 . . . . 10.0 113.042 -174.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.9 18.17 79.08 Favored Glycine 0 CA--C 1.534 1.226 0 C-N-CA 124.042 0.829 . . . . 10.0 113.003 -173.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.76 148.57 92.54 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 118.52 1.16 . . . . 10.0 112.649 -178.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.4 ' CG ' ' HE3' ' A' ' 78' ' ' LYS . 87.0 Cg_endo -76.14 153.3 36.37 Favored 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 124.958 3.772 . . . . 10.0 110.272 179.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.1 mttt -67.69 144.48 55.45 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 116.459 -0.337 . . . . 10.0 111.83 -172.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.3 m -34.26 -43.11 0.15 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.898 1.679 . . . . 10.0 113.679 169.129 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 22.2 p80 -143.61 110.31 5.56 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.661 0.743 . . . . 10.0 109.765 173.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -129.05 162.93 26.53 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 106.44 -1.689 . . . . 10.0 106.44 174.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 90.2 m -106.17 -36.2 6.97 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 118.756 0.707 . . . . 10.0 111.157 169.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.06 -26.57 59.49 Favored 'General case' 0 CA--C 1.534 0.333 0 O-C-N 120.63 -1.294 . . . . 10.0 112.735 179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -90.07 -8.46 51.39 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 125.864 1.666 . . . . 10.0 110.645 -179.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.441 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 48.5 m95 -110.73 -29.91 7.8 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 120.699 -1.25 . . . . 10.0 109.884 176.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -39.49 -60.58 1.24 Allowed Pre-proline 0 CA--C 1.542 0.671 0 C-N-CA 125.496 1.518 . . . . 10.0 114.292 170.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -67.99 2.4 2.65 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 122.295 1.997 . . . . 10.0 113.898 -177.008 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -113.51 -47.33 3.0 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 125.246 1.419 . . . . 10.0 110.48 176.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.548 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -63.34 -18.7 63.92 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.731 1.613 . . . . 10.0 112.911 173.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.12 -31.38 61.1 Favored 'General case' 0 N--CA 1.457 -0.104 0 C-N-CA 124.648 1.179 . . . . 10.0 109.588 178.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 44.1 mmtt -77.79 -56.14 4.75 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.251 -0.431 . . . . 10.0 110.313 171.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.09 -114.25 0.65 Allowed Glycine 0 CA--C 1.531 1.039 0 N-CA-C 111.987 -0.445 . . . . 10.0 111.987 173.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -138.86 168.16 19.64 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.076 0 C-N-CA 125.567 1.547 . . . . 10.0 109.796 175.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.412 ' HA ' HG12 ' A' ' 43' ' ' VAL . 0.7 OUTLIER 76.18 -34.04 0.23 Allowed 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 125.331 1.452 . . . . 10.0 112.212 -174.204 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -57.3 -24.4 54.75 Favored 'General case' 0 N--CA 1.467 0.379 0 O-C-N 120.241 -1.537 . . . . 10.0 114.124 -177.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -105.92 -33.9 7.79 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.461 1.104 . . . . 10.0 111.939 -178.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.412 HG12 ' HA ' ' A' ' 40' ' ' ASP . 0.5 OUTLIER -56.53 -35.11 43.42 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 O-C-N 121.299 -0.876 . . . . 10.0 109.751 170.402 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -59.13 -42.72 91.29 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 113.972 1.101 . . . . 10.0 113.972 168.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 56.9 m -65.9 -39.5 90.66 Favored 'General case' 0 CA--C 1.531 0.229 0 O-C-N 120.688 -1.258 . . . . 10.0 110.442 179.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 15.6 t -56.31 -51.75 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.49 0.716 . . . . 10.0 110.811 176.604 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -62.95 -33.83 76.2 Favored 'General case' 0 CA--C 1.536 0.429 0 N-CA-C 112.961 0.726 . . . . 10.0 112.961 176.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 85.3 m -72.31 -24.32 61.3 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.211 0.605 . . . . 10.0 112.314 178.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.28 92.56 0.3 Allowed Glycine 0 CA--C 1.533 1.218 0 CA-C-N 119.298 0.954 . . . . 10.0 112.371 -178.486 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.61 -179.09 1.02 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 122.215 1.007 . . . . 10.0 111.951 175.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -55.97 -54.84 39.98 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 123.557 1.646 . . . . 10.0 111.243 -163.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.407 ' HB3' HMD2 ' A' ' 90' ' ' HEC . . . -96.93 20.77 10.59 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 128.002 2.521 . . . . 10.0 111.927 176.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -130.75 128.39 22.44 Favored Pre-proline 0 CA--C 1.545 0.76 0 N-CA-C 113.341 0.867 . . . . 10.0 113.341 -177.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -70.02 157.76 58.81 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 121.497 1.465 . . . . 10.0 111.13 178.06 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -63.83 114.11 2.45 Favored 'Trans proline' 0 N--CA 1.458 -0.574 0 C-N-CA 123.415 2.743 . . . . 10.0 109.846 -177.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 92.61 11.94 58.76 Favored Glycine 0 CA--C 1.53 0.982 0 CA-C-O 119.853 -0.415 . . . . 10.0 114.097 -171.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.39 -44.06 2.39 Favored Glycine 0 CA--C 1.534 1.224 0 CA-C-N 118.692 1.246 . . . . 10.0 113.486 173.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.26 -47.31 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.793 1.637 . . . . 10.0 111.893 172.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -79.68 159.11 26.82 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.211 1.404 . . . . 10.0 111.673 178.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 86.2 m -103.6 -64.17 1.12 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.744 1.218 . . . . 10.0 112.041 175.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.0 t0 -80.92 56.62 2.8 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.967 0.907 . . . . 10.0 110.784 -173.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.405 ' HB2' ' CE2' ' A' ' 67' ' ' TYR . 0.0 OUTLIER -101.12 139.72 36.41 Favored 'General case' 0 CA--C 1.527 0.063 0 C-N-CA 124.642 1.177 . . . . 10.0 110.802 -173.73 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 9.0 m -110.77 143.93 40.53 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 124.12 0.968 . . . . 10.0 108.971 -176.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -47.09 -36.89 8.79 Favored 'General case' 0 N--CA 1.453 -0.305 0 N-CA-C 114.056 1.132 . . . . 10.0 114.056 177.372 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 16.8 pt-20 -51.33 -52.62 43.82 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 119.229 0.922 . . . . 10.0 111.78 170.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.76 -46.32 54.02 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.957 0.799 . . . . 10.0 110.635 178.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.405 ' CE2' ' HB2' ' A' ' 62' ' ' CYS . 1.6 m-85 -58.99 -51.66 69.11 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 120.838 -1.164 . . . . 10.0 111.424 -179.007 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.0 mtpm? -68.01 -45.03 75.17 Favored 'General case' 0 C--O 1.22 -0.456 0 CA-C-O 117.673 -1.156 . . . . 10.0 109.271 -177.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.407 ' HB3' ' HB2' ' A' ' 3' ' ' ALA . . . -52.66 -31.3 36.34 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.796 1.18 . . . . 10.0 112.887 169.213 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -80.74 -36.55 31.89 Favored 'General case' 0 C--O 1.222 -0.342 0 O-C-N 120.694 -1.254 . . . . 10.0 112.1 -177.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 6.0 mt -74.24 -48.27 37.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 125.154 1.381 . . . . 10.0 111.281 174.015 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -27.75 67.2 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 124.414 1.086 . . . . 10.0 113.312 175.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 32.4 t80 -46.23 -38.72 8.81 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 112.666 0.617 . . . . 10.0 112.666 171.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.441 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -87.36 -71.29 0.57 Allowed 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 122.946 0.498 . . . . 10.0 112.018 -177.356 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 4.3 t -160.13 36.49 0.17 Allowed 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.495 0.718 . . . . 10.0 112.312 -179.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 3.5 ptmm? 33.23 66.55 0.21 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 126.349 1.859 . . . . 10.0 114.796 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.548 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -163.17 -49.18 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 115.141 -0.936 . . . . 10.0 113.356 -178.209 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.436 ' HE2' ' C3A' ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.72 0 CA-C-O 118.089 -0.958 . . . . 10.0 111.511 179.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.707 HMC1 ' CBC' ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.168 0 N-CA-C 114.008 1.114 . . . . 10.0 114.008 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -164.01 130.03 3.05 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.611 0.764 . . . . 10.0 109.514 -171.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . 0.671 HD13 ' CD1' ' A' ' 6' ' ' ILE . 2.0 mm? -78.0 54.65 1.34 Allowed 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.149 0.98 . . . . 10.0 111.326 -178.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -111.23 -22.07 11.58 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 125.656 1.582 . . . . 10.0 112.931 -178.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -151.87 121.07 6.73 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 124.191 0.996 . . . . 10.0 109.782 -174.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -42.83 -44.39 4.45 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 125.132 1.373 . . . . 10.0 113.693 170.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -55.96 -50.99 69.25 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.94 0.4 . . . . 10.0 110.312 175.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.33 -31.83 70.54 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 121.775 -0.578 . . . . 10.0 111.27 -176.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.671 ' CD1' HD13 ' A' ' -1' ' ' LEU . 44.1 mt -67.59 -51.94 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.221 0 N-CA-C 109.333 -0.617 . . . . 10.0 109.333 178.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -69.24 -41.68 76.64 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 119.077 -1.049 . . . . 10.0 111.025 178.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -67.15 -21.42 65.82 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.315 1.446 . . . . 10.0 112.161 -177.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.41 -27.53 18.26 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.445 1.276 . . . . 10.0 114.445 166.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.69 -70.7 0.8 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.796 1.238 . . . . 10.0 111.582 -168.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.98 38.69 0.17 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 126.115 1.766 . . . . 10.0 110.224 179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.9 t -119.26 -6.13 10.38 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 125.301 1.44 . . . . 10.0 113.833 -167.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 20.7 t -93.86 -38.06 9.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-O 122.322 1.058 . . . . 10.0 108.304 -175.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 60.6 m -110.83 -60.18 1.86 Allowed 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 126.474 1.909 . . . . 10.0 109.507 -167.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -74.49 -26.12 59.81 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 114.061 1.134 . . . . 10.0 114.061 -170.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.9 t -58.55 -55.0 40.72 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.966 0.906 . . . . 10.0 110.916 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 20.8 mmt -101.07 -23.87 14.41 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.645 1.178 . . . . 10.0 112.06 -178.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.64 52.93 2.7 Favored Glycine 0 CA--C 1.537 1.447 0 C-N-CA 124.92 1.248 . . . . 10.0 112.08 -174.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 61.7 t -93.25 156.17 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.332 0 C-N-CA 125.389 1.475 . . . . 10.0 109.525 -179.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.78 25.05 11.44 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.263 1.025 . . . . 10.0 113.106 -176.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.06 12.05 83.62 Favored Glycine 0 CA--C 1.535 1.306 0 C-N-CA 123.83 0.729 . . . . 10.0 113.206 -175.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -61.14 152.31 72.2 Favored Pre-proline 0 CA--C 1.541 0.629 0 CA-C-N 118.289 1.044 . . . . 10.0 111.995 177.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -76.26 169.51 21.85 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 123.739 2.959 . . . . 10.0 110.538 -177.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -78.07 146.68 35.11 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.634 -0.666 . . . . 10.0 112.382 -179.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -49.17 -30.32 6.66 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.093 1.357 . . . . 10.0 113.976 168.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 15.6 p80 -146.44 114.92 6.75 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.045 -1.034 . . . . 10.0 110.006 174.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.412 HD22 ' CG ' ' A' ' 30' ' ' ASP . 5.3 m-20 -144.54 168.47 20.08 Favored 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 107.782 -1.192 . . . . 10.0 107.782 174.297 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 97.5 m -109.61 -32.38 7.13 Favored 'General case' 0 C--O 1.222 -0.389 0 CA-C-O 119.294 -0.384 . . . . 10.0 110.955 167.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.57 -28.4 45.88 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 114.6 1.333 . . . . 10.0 114.6 -175.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.412 ' CG ' HD22 ' A' ' 27' ' ' ASN . 0.7 OUTLIER -81.15 -33.45 33.14 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-O 121.908 0.861 . . . . 10.0 109.498 176.061 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.452 ' CE3' ' HB2' ' A' ' 75' ' ' SER . 62.7 m95 -77.7 -41.08 39.21 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.155 0.982 . . . . 10.0 109.997 -179.632 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -39.92 -65.04 0.46 Allowed Pre-proline 0 CA--C 1.549 0.907 0 CA-C-N 120.627 1.558 . . . . 10.0 114.9 174.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -70.9 -0.65 8.19 Favored 'Trans proline' 0 CA--C 1.538 0.711 0 C-N-CA 123.512 2.808 . . . . 10.0 113.495 -178.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.72 -34.67 9.76 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.311 1.444 . . . . 10.0 109.905 170.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.8 tp -98.53 20.68 12.38 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 128.228 2.611 . . . . 10.0 111.998 -173.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -106.89 16.29 24.48 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.638 1.575 . . . . 10.0 110.346 174.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -133.2 -45.3 0.84 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 126.434 1.894 . . . . 10.0 110.504 179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 163.46 -142.59 7.96 Favored Glycine 0 CA--C 1.527 0.831 0 N-CA-C 109.343 -1.503 . . . . 10.0 109.343 -179.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.1 t -129.75 -55.01 1.17 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.278 0 C-N-CA 123.783 0.833 . . . . 10.0 109.737 -177.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -73.64 32.93 0.08 Allowed 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 126.216 1.806 . . . . 10.0 113.294 -177.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.2 m-20 -106.06 -46.56 4.06 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 128.151 2.58 . . . . 10.0 108.044 176.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 42' ' ' LEU . 1.4 mm? -83.17 -40.22 19.99 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.016 0.927 . . . . 10.0 111.51 -173.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 p -55.9 -26.6 21.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 CA-C-O 121.612 0.72 . . . . 10.0 110.523 171.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.3 mmtt -72.6 -37.35 68.15 Favored 'General case' 0 CA--C 1.546 0.813 0 O-C-N 121.333 -0.854 . . . . 10.0 112.561 173.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.7 m -67.25 -32.98 74.37 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 121.973 0.892 . . . . 10.0 110.573 174.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.5 t -57.84 -49.33 81.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 O-C-N 121.443 -0.785 . . . . 10.0 111.858 171.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -28.45 69.66 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 113.062 0.764 . . . . 10.0 113.062 -177.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 51.0 p -83.59 -29.62 27.62 Favored 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 112.941 0.719 . . . . 10.0 112.941 174.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.0 101.22 0.33 Allowed Glycine 0 CA--C 1.527 0.818 0 CA-C-N 118.663 0.665 . . . . 10.0 112.445 -171.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.27 173.94 1.36 Allowed 'General case' 0 CA--C 1.547 0.83 0 CA-C-O 121.437 0.637 . . . . 10.0 111.141 165.22 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.525 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 10.3 m-80 -47.69 -57.88 4.98 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.439 1.496 . . . . 10.0 114.136 -167.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -99.26 23.48 9.15 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.359 1.464 . . . . 10.0 111.264 177.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -112.55 154.99 44.48 Favored Pre-proline 0 CA--C 1.541 0.624 0 N-CA-C 114.735 1.383 . . . . 10.0 114.735 172.053 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -76.06 134.44 16.1 Favored 'Trans proline' 0 CA--C 1.543 0.96 0 C-N-CA 122.782 2.321 . . . . 10.0 110.539 175.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -66.56 117.27 4.6 Favored 'Trans proline' 0 N--CA 1.457 -0.626 0 C-N-CA 123.124 2.549 . . . . 10.0 110.288 178.224 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 90.76 30.91 10.7 Favored Glycine 0 C--N 1.343 0.926 0 C-N-CA 120.102 -1.047 . . . . 10.0 110.546 -177.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.18 38.5 6.41 Favored Glycine 0 CA--C 1.531 1.054 0 CA-C-N 117.728 0.764 . . . . 10.0 114.482 178.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 73.48 -59.51 0.56 Allowed 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.163 1.385 . . . . 10.0 111.367 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.4 t -82.76 98.31 9.03 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 125.151 1.38 . . . . 10.0 110.798 170.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.1 t -59.91 -42.11 93.16 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 116.272 -0.422 . . . . 10.0 111.422 169.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -79.41 57.22 2.32 Favored 'General case' 0 CA--C 1.548 0.904 0 C-N-CA 125.036 1.334 . . . . 10.0 111.189 -177.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.658 ' SG ' HD11 ' A' ' -1' ' ' LEU . 1.9 m -127.97 134.43 49.28 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 126.105 1.762 . . . . 10.0 110.975 -175.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 m -103.75 141.7 35.64 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.772 0.829 . . . . 10.0 109.942 -178.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -44.32 -34.95 2.13 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 114.028 1.121 . . . . 10.0 114.028 177.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -45.42 -56.65 4.78 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.502 1.121 . . . . 10.0 110.807 169.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -77.89 -44.59 26.64 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.434 1.494 . . . . 10.0 108.8 -175.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -59.68 -47.43 85.65 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.012 1.325 . . . . 10.0 110.542 -174.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 3.0 mtpm? -69.48 -44.46 71.11 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 121.526 -0.733 . . . . 10.0 111.144 174.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.59 -27.41 6.75 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 119.288 0.949 . . . . 10.0 112.905 170.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.11 -46.48 11.9 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.139 -0.976 . . . . 10.0 110.656 173.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.2 tp -53.42 -34.94 23.86 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 C-N-CA 124.695 1.198 . . . . 10.0 113.214 176.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.44 -17.95 29.34 Favored 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 125.288 1.435 . . . . 10.0 113.214 177.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -53.05 -44.99 67.85 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.402 -0.811 . . . . 10.0 111.941 174.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.3 mpp? -71.62 -62.19 1.5 Allowed 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.479 1.112 . . . . 10.0 112.362 177.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.452 ' HB2' ' CE3' ' A' ' 31' ' ' TRP . 15.4 m -141.66 -93.84 0.14 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.215 1.006 . . . . 10.0 110.056 172.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 5.8 ptmt -174.89 56.11 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.984 1.313 . . . . 10.0 109.022 176.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.71 -75.38 0.05 Allowed 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 114.26 1.207 . . . . 10.0 114.26 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.41 ' HG3' ' CE3' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.186 0 N-CA-C 115.761 1.763 . . . . 10.0 115.761 -160.376 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.811 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.083 0 CA-C-O 117.79 -1.1 . . . . 10.0 109.445 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -162.18 125.91 3.1 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.955 -0.758 . . . . 10.0 108.955 179.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.27 69.38 3.54 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-O 122.344 1.069 . . . . 10.0 110.088 -178.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.13 -21.64 11.84 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.424 1.489 . . . . 10.0 112.47 171.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -147.22 122.75 10.42 Favored 'General case' 0 N--CA 1.445 -0.679 0 CA-C-O 121.433 0.635 . . . . 10.0 109.459 -176.407 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -45.25 -40.77 7.81 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.794 1.238 . . . . 10.0 113.522 167.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -54.87 -50.82 67.76 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-N 118.117 0.417 . . . . 10.0 110.617 172.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.38 -31.52 70.95 Favored 'General case' 0 CA--C 1.529 0.136 0 O-C-N 122.022 -0.424 . . . . 10.0 110.647 -178.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -65.75 -51.99 55.42 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 108.633 -0.877 . . . . 10.0 108.633 177.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.429 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.74 -41.95 74.59 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 118.951 -1.1 . . . . 10.0 111.251 -177.954 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -68.17 -22.05 64.86 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.809 1.644 . . . . 10.0 112.16 -177.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -92.42 -29.07 16.47 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 113.932 1.086 . . . . 10.0 113.932 166.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.478 ' O ' HMC3 ' A' ' 90' ' ' HEC . . . -106.05 -67.27 0.94 Allowed 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 124.263 1.025 . . . . 10.0 112.933 -170.547 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.429 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.73 43.05 0.39 Allowed 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.883 1.273 . . . . 10.0 109.374 -179.1 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 t -126.79 -5.0 6.37 Favored 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 125.333 1.453 . . . . 10.0 113.501 -165.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 41.2 t -99.02 -51.63 9.85 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.556 0 C-N-CA 124.985 1.314 . . . . 10.0 108.083 -177.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 80.4 m -92.01 -59.01 2.21 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 126.426 1.891 . . . . 10.0 109.906 -174.091 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 29.4 m-70 -73.97 -16.92 61.06 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 114.033 1.123 . . . . 10.0 114.033 -171.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.7 t -65.34 -50.01 67.22 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 121.766 -0.584 . . . . 10.0 111.24 -178.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.1 tpt -106.96 -26.27 11.26 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.291 1.036 . . . . 10.0 112.256 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 95.78 55.22 1.33 Allowed Glycine 0 CA--C 1.535 1.343 0 C-N-CA 125.211 1.386 . . . . 10.0 111.9 -174.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 90.8 t -95.6 156.46 3.24 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 125.291 1.437 . . . . 10.0 109.69 -179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.12 25.95 11.49 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.218 1.007 . . . . 10.0 112.802 -174.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 78.74 7.44 88.21 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 124.105 0.86 . . . . 10.0 113.508 -175.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.43 147.03 92.73 Favored Pre-proline 0 CA--C 1.55 0.977 0 CA-C-N 118.807 1.304 . . . . 10.0 112.35 -179.338 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 70.3 Cg_endo -67.12 172.23 10.22 Favored 'Trans proline' 0 CA--C 1.536 0.585 0 C-N-CA 125.099 3.866 . . . . 10.0 110.29 172.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -124.26 135.33 53.33 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.763 0.825 . . . . 10.0 111.52 -176.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 15.7 p -78.79 52.89 1.28 Allowed 'General case' 0 CA--C 1.54 0.579 0 O-C-N 120.825 -1.172 . . . . 10.0 113.166 179.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -146.54 -43.3 0.19 Allowed 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.885 1.439 . . . . 10.0 114.885 178.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -79.67 146.13 32.62 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.932 1.293 . . . . 10.0 108.877 178.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 38.2 m -94.44 -29.0 15.19 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.253 0.933 . . . . 10.0 110.155 -178.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.46 -29.85 68.1 Favored 'General case' 0 CA--C 1.538 0.489 0 N-CA-C 113.689 0.996 . . . . 10.0 113.689 177.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.458 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 60.7 t0 -71.32 -34.03 70.2 Favored 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 124.434 1.094 . . . . 10.0 109.26 174.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.434 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 49.0 m95 -90.03 -31.27 17.26 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 125.094 1.358 . . . . 10.0 113.254 -175.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -47.01 -56.59 11.48 Favored Pre-proline 0 CA--C 1.541 0.613 0 O-C-N 120.493 -1.379 . . . . 10.0 114.603 174.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -67.43 -0.02 4.59 Favored 'Trans proline' 0 CA--C 1.536 0.596 0 C-N-CA 122.579 2.186 . . . . 10.0 113.278 -178.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -93.6 -49.19 6.0 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.499 -0.751 . . . . 10.0 109.567 170.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.36 22.8 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.533 1.308 . . . . 10.0 114.533 170.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -93.94 -37.76 11.53 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.396 1.078 . . . . 10.0 109.698 176.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt -85.83 -46.01 11.04 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 123.948 0.899 . . . . 10.0 111.151 175.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 152.81 -143.58 10.46 Favored Glycine 0 CA--C 1.534 1.248 0 N-CA-C 110.353 -1.099 . . . . 10.0 110.353 -177.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 14.8 t -123.76 -54.53 2.56 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 C-N-CA 124.194 0.998 . . . . 10.0 110.901 -174.212 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -58.95 -13.85 7.6 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.443 1.497 . . . . 10.0 113.207 -178.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.4 m-80 -72.84 -16.04 61.61 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 126.093 1.757 . . . . 10.0 113.47 175.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 mp -103.9 -43.99 5.16 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.228 0.611 . . . . 10.0 110.379 -171.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.3 p -53.8 -34.15 24.57 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.05 0.54 . . . . 10.0 111.103 170.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.6 ptmt -63.51 -43.96 95.68 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 120.823 -1.173 . . . . 10.0 113.91 170.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.5 m -66.55 -32.72 74.24 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 120.631 -1.293 . . . . 10.0 110.034 -178.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 40.5 t -60.43 -54.89 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 C-N-CA 123.563 0.745 . . . . 10.0 111.099 172.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.62 -31.9 69.92 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 112.903 0.705 . . . . 10.0 112.903 178.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.8 m -71.1 -27.48 63.62 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.442 0.697 . . . . 10.0 112.471 177.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 74.31 90.68 0.17 Allowed Glycine 0 CA--C 1.529 0.969 0 CA-C-N 119.196 0.907 . . . . 10.0 112.539 -175.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.41 168.51 2.71 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.961 0.886 . . . . 10.0 111.634 173.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.493 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 8.5 m-80 -52.98 -57.96 8.58 Favored 'General case' 0 N--CA 1.471 0.625 0 O-C-N 120.468 -1.395 . . . . 10.0 112.85 -169.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -85.6 17.94 3.04 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.189 1.396 . . . . 10.0 112.722 173.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.4 ttp -131.66 130.26 22.31 Favored Pre-proline 0 CA--C 1.545 0.763 0 N-CA-C 115.021 1.489 . . . . 10.0 115.021 -175.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 36.4 Cg_endo -65.08 143.04 76.98 Favored 'Trans proline' 0 CA--C 1.544 1.005 0 C-N-CA 121.452 1.434 . . . . 10.0 112.309 -178.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -61.92 133.06 42.53 Favored 'Trans proline' 0 N--CA 1.459 -0.502 0 C-N-CA 123.679 2.919 . . . . 10.0 109.946 -178.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.79 11.75 85.13 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 119.579 -1.296 . . . . 10.0 112.735 -173.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 56.81 53.94 40.32 Favored Glycine 0 CA--C 1.532 1.138 0 O-C-N 120.74 -1.447 . . . . 10.0 110.88 179.914 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER 80.12 -45.52 0.29 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 126.835 2.054 . . . . 10.0 112.603 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -79.08 162.39 25.89 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.642 0.777 . . . . 10.0 111.583 175.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.7 m -114.42 -57.41 2.28 Favored 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 124.315 1.046 . . . . 10.0 110.504 173.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.9 t0 -82.48 68.03 8.76 Favored 'General case' 0 CA--C 1.541 0.631 0 CA-C-O 122.418 1.104 . . . . 10.0 109.871 -178.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -109.76 116.79 32.34 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 125.837 1.655 . . . . 10.0 110.432 -177.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.1 p -84.48 130.63 34.74 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 126.557 1.943 . . . . 10.0 109.334 -178.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -45.58 -35.72 4.19 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.898 0.879 . . . . 10.0 113.261 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -50.17 -59.76 3.62 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.187 0.995 . . . . 10.0 113.162 167.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -74.62 -26.47 59.92 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 120.961 -1.087 . . . . 10.0 109.907 -177.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -65.94 -55.82 14.91 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.909 1.284 . . . . 10.0 110.959 177.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.55 -44.49 96.93 Favored 'General case' 0 C--O 1.223 -0.305 0 N-CA-C 108.782 -0.822 . . . . 10.0 108.782 177.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.75 -24.96 38.34 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.412 0.523 . . . . 10.0 112.412 173.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -85.61 -48.0 9.3 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 121.534 -0.729 . . . . 10.0 109.86 176.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 1.2 tp -57.42 -30.33 35.67 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.649 0 C-N-CA 125.705 1.602 . . . . 10.0 112.747 178.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.63 -28.56 23.14 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.205 1.002 . . . . 10.0 113.549 173.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.7 t80 -51.87 -51.35 57.33 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.431 1.014 . . . . 10.0 112.139 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.434 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.3 mpp? -64.96 -36.87 85.78 Favored 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.718 0.636 . . . . 10.0 112.718 178.071 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -166.8 -74.18 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.465 0.706 . . . . 10.0 110.934 172.12 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 164.1 43.58 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 128.281 2.632 . . . . 10.0 110.842 -170.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.63 -81.58 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 115.418 1.636 . . . . 10.0 115.418 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.458 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 3.0 ptpt . . . . . 0 C--O 1.251 1.149 0 CA-C-O 117.282 -1.342 . . . . 10.0 113.925 -176.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.88 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.063 0 CA-C-O 117.934 -1.032 . . . . 10.0 109.188 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -162.16 35.75 0.12 Allowed 'General case' 0 CA--C 1.545 0.782 0 CA-C-O 122.68 1.228 . . . . 10.0 111.377 -164.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . 0.798 HD13 ' H ' ' A' ' -1' ' ' LEU . 0.0 OUTLIER -74.07 51.23 0.4 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 127.001 2.12 . . . . 10.0 112.245 172.278 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -101.51 -23.07 14.37 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.76 1.224 . . . . 10.0 111.013 173.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 58.5 t0 -149.52 119.82 7.32 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.198 0.999 . . . . 10.0 110.007 173.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -44.52 -42.34 7.12 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.004 1.321 . . . . 10.0 113.93 167.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -57.94 -46.58 84.83 Favored 'General case' 0 N--CA 1.455 -0.189 0 O-C-N 122.208 -0.307 . . . . 10.0 110.428 173.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.41 -34.18 76.71 Favored 'General case' 0 N--CA 1.455 -0.218 0 O-C-N 121.963 -0.461 . . . . 10.0 110.701 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.5 mm -64.86 -51.25 69.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 O-C-N 121.575 -0.703 . . . . 10.0 109.143 178.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.414 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.1 -42.01 76.68 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 117.791 -1.563 . . . . 10.0 111.988 179.514 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -68.61 -22.0 64.47 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.513 1.525 . . . . 10.0 112.579 -176.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -92.64 -29.21 16.24 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.548 1.139 . . . . 10.0 113.249 170.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.18 -64.49 1.29 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.143 0.977 . . . . 10.0 112.995 -170.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.414 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.04 37.81 0.16 Allowed 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.811 1.244 . . . . 10.0 110.887 178.184 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -120.57 -1.35 10.1 Favored 'General case' 0 CA--C 1.522 -0.133 0 C-N-CA 125.024 1.329 . . . . 10.0 113.316 -165.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.2 t -105.66 -46.57 8.92 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 124.647 1.179 . . . . 10.0 108.874 -171.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 6.9 m -87.82 -64.52 1.14 Allowed 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 125.703 1.601 . . . . 10.0 111.571 174.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 75.0 m-70 -72.57 -25.57 61.4 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.565 0.746 . . . . 10.0 112.993 -162.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.8 t -55.01 -50.31 69.36 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 124.874 1.269 . . . . 10.0 111.094 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.5 tpt -106.08 -21.29 13.17 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 123.945 0.898 . . . . 10.0 112.635 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.56 45.27 3.76 Favored Glycine 0 CA--C 1.536 1.366 0 C-N-CA 124.138 0.875 . . . . 10.0 112.353 -176.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 57.7 t -86.06 160.18 3.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 124.568 1.147 . . . . 10.0 109.384 177.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.97 17.16 5.15 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.806 1.243 . . . . 10.0 113.531 -175.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.84 18.38 78.91 Favored Glycine 0 CA--C 1.535 1.282 0 C-N-CA 124.128 0.87 . . . . 10.0 113.417 -173.416 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.0 143.55 98.02 Favored Pre-proline 0 CA--C 1.542 0.67 0 CA-C-N 118.507 1.154 . . . . 10.0 112.831 -177.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 94.1 Cg_endo -66.96 147.47 80.31 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 124.142 3.228 . . . . 10.0 110.118 177.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 6.8 tmtt? -69.1 139.49 54.77 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.474 -0.33 . . . . 10.0 110.792 -167.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 72.4 m -37.96 -35.3 0.15 Allowed 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 125.48 1.512 . . . . 10.0 114.512 173.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.7 p-80 -141.94 108.75 5.4 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 125.737 1.615 . . . . 10.0 107.862 174.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -135.28 167.28 21.31 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.757 1.623 . . . . 10.0 106.737 171.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 88.2 m -110.84 -35.77 5.87 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-N 118.385 0.539 . . . . 10.0 112.123 171.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.05 -17.19 44.13 Favored 'General case' 0 N--CA 1.466 0.331 0 O-C-N 121.119 -0.988 . . . . 10.0 113.072 -178.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -85.23 -29.77 24.39 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.272 1.829 . . . . 10.0 110.114 178.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.462 ' CZ3' ' HB2' ' A' ' 74' ' ' MET . 50.4 m95 -92.61 -38.34 11.94 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 126.869 2.068 . . . . 10.0 111.204 179.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -41.78 -60.52 1.89 Allowed Pre-proline 0 CA--C 1.552 1.038 0 N-CA-C 114.79 1.404 . . . . 10.0 114.79 173.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -64.24 -4.79 8.43 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.561 2.841 . . . . 10.0 114.053 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.5 mmt180 -98.25 -53.02 3.48 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 125.748 1.619 . . . . 10.0 108.308 178.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.475 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 1.4 mt -58.9 -19.39 41.79 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.566 1.547 . . . . 10.0 113.338 174.019 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.16 -30.58 55.07 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.143 1.377 . . . . 10.0 109.488 -177.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.1 mttt -82.57 -52.2 7.05 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 109.854 -0.424 . . . . 10.0 109.854 174.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.531 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 167.99 -125.26 1.28 Allowed Glycine 0 CA--C 1.532 1.106 0 N-CA-C 111.339 -0.704 . . . . 10.0 111.339 177.319 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 2.7 t -141.61 -59.71 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.43 0 CA-C-O 122.105 0.955 . . . . 10.0 109.461 -178.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -71.69 17.35 0.09 Allowed 'General case' 0 CA--C 1.562 1.433 0 C-N-CA 124.277 1.031 . . . . 10.0 112.652 -173.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.531 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -98.43 -18.36 18.29 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 128.249 2.62 . . . . 10.0 110.39 177.366 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -101.51 -41.92 6.44 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.999 0.92 . . . . 10.0 111.053 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.3 p -49.62 -35.38 9.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-O 121.477 0.656 . . . . 10.0 111.264 170.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 7.2 ptmt -63.66 -44.39 93.91 Favored 'General case' 0 CA--C 1.538 0.494 0 N-CA-C 114.707 1.373 . . . . 10.0 114.707 172.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -70.14 -23.61 63.03 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 119.156 0.889 . . . . 10.0 110.91 178.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.0 t -67.33 -53.92 28.45 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 O-C-N 121.584 -0.697 . . . . 10.0 111.703 168.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.51 -34.82 74.65 Favored 'General case' 0 CA--C 1.54 0.558 0 O-C-N 121.949 -0.469 . . . . 10.0 112.035 177.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -74.64 -31.32 61.92 Favored 'General case' 0 N--CA 1.467 0.419 0 C-N-CA 123.39 0.676 . . . . 10.0 112.169 177.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.0 105.5 0.15 Allowed Glycine 0 C--N 1.341 0.808 0 N-CA-C 111.485 -0.646 . . . . 10.0 111.485 -166.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.5 tp -63.14 172.01 2.04 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 121.877 -0.778 . . . . 10.0 110.247 167.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.505 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 7.8 m-80 -49.02 -58.27 5.18 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 124.742 1.217 . . . . 10.0 113.488 -169.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -86.09 18.97 2.81 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.018 1.327 . . . . 10.0 112.923 174.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 5.9 mtp -119.24 147.28 42.65 Favored Pre-proline 0 CA--C 1.543 0.709 0 N-CA-C 114.269 1.211 . . . . 10.0 114.269 173.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.29 141.44 32.13 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 122.137 1.891 . . . . 10.0 110.425 172.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -61.6 124.36 14.48 Favored 'Trans proline' 0 N--CA 1.457 -0.63 0 C-N-CA 123.003 2.469 . . . . 10.0 109.884 178.081 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 88.67 17.03 57.52 Favored Glycine 0 C--N 1.34 0.776 0 C-N-CA 119.994 -1.098 . . . . 10.0 111.824 -178.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 52.93 36.3 50.51 Favored Glycine 0 CA--C 1.535 1.326 0 CA-C-N 118.875 1.337 . . . . 10.0 113.511 172.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER 66.54 21.99 10.65 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 126.323 1.849 . . . . 10.0 114.102 -175.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 11.9 t -122.74 166.61 14.65 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 126.287 1.835 . . . . 10.0 110.577 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.8 t -115.47 -55.59 2.43 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 124.393 1.077 . . . . 10.0 111.551 177.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -115.43 49.97 1.04 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.714 1.206 . . . . 10.0 110.99 -177.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.9 m -80.09 117.54 20.99 Favored 'General case' 0 N--CA 1.463 0.194 0 O-C-N 120.394 -1.441 . . . . 10.0 110.624 174.74 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 34.7 p -79.7 139.0 37.51 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.096 -0.705 . . . . 10.0 109.096 177.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -45.51 -32.22 2.14 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.757 0.823 . . . . 10.0 113.202 176.765 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -52.61 -61.8 2.05 Favored 'General case' 0 CA--C 1.542 0.639 0 CA-C-N 119.257 0.935 . . . . 10.0 112.535 169.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.58 -27.77 62.39 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.551 -0.718 . . . . 10.0 110.495 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -70.03 -50.02 45.45 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-O 122.46 1.124 . . . . 10.0 109.972 -177.521 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -64.85 -51.65 60.88 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 124.58 1.152 . . . . 10.0 109.021 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -48.43 -35.07 12.07 Favored 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 118.871 0.759 . . . . 10.0 112.523 173.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -75.27 -34.04 61.31 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 120.946 -1.096 . . . . 10.0 112.213 178.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -72.65 -51.57 27.42 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 126.048 1.739 . . . . 10.0 110.7 175.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.6 -28.32 69.84 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 125.033 1.333 . . . . 10.0 112.881 178.508 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -42.16 -41.34 2.64 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.884 0.698 . . . . 10.0 112.884 170.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.462 ' HB2' ' CZ3' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -77.59 -69.77 0.52 Allowed 'General case' 0 CA--C 1.542 0.673 0 N-CA-C 111.998 0.369 . . . . 10.0 111.998 179.854 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.8 t -163.08 32.23 0.09 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 113.685 0.995 . . . . 10.0 113.685 -176.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER 37.29 53.95 1.3 Allowed 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 126.443 1.897 . . . . 10.0 115.047 177.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.475 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -140.77 -54.64 0.5 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 123.923 0.889 . . . . 10.0 112.836 -177.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.534 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.898 0 CA-C-O 116.666 -1.635 . . . . 10.0 110.559 171.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.71 HMC1 ' CBC' ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.897 0 CA-C-O 118.589 -0.72 . . . . 10.0 111.357 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -162.39 129.48 3.73 Favored 'General case' 0 CA--C 1.539 0.533 0 N-CA-C 112.734 0.642 . . . . 10.0 112.734 -170.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.51 76.24 1.45 Allowed 'General case' 0 CA--C 1.543 0.681 0 CA-C-O 122.676 1.227 . . . . 10.0 109.123 171.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.85 -24.96 8.84 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.928 1.291 . . . . 10.0 114.281 175.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -136.93 -168.09 2.21 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 106.218 -1.771 . . . . 10.0 106.218 -177.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -103.34 -41.75 5.93 Favored 'General case' 0 N--CA 1.441 -0.884 0 C-N-CA 127.522 2.329 . . . . 10.0 111.998 176.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -54.85 -51.5 65.7 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 122.195 0.997 . . . . 10.0 109.772 178.048 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.96 -30.08 69.28 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-N 115.144 -0.935 . . . . 10.0 110.858 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.56 -52.0 45.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 N-CA-C 109.361 -0.607 . . . . 10.0 109.361 178.68 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.404 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.5 OUTLIER -69.71 -40.08 76.49 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 118.758 0.708 . . . . 10.0 110.39 -176.769 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.0 t-20 -68.94 -23.95 64.21 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.391 1.077 . . . . 10.0 112.035 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.41 -30.66 19.32 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 114.612 1.338 . . . . 10.0 114.612 166.335 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.65 -69.54 0.86 Allowed 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.959 1.304 . . . . 10.0 111.637 -167.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.404 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.38 43.95 0.25 Allowed 'General case' 0 CA--C 1.556 1.182 0 C-N-CA 125.516 1.526 . . . . 10.0 110.345 178.612 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.9 t -127.1 -7.13 5.98 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 125.701 1.601 . . . . 10.0 113.668 -167.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 48.4 t -94.17 -42.72 12.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.56 0 N-CA-C 108.243 -1.021 . . . . 10.0 108.243 -175.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 38.9 m -104.97 -57.2 2.06 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 125.737 1.615 . . . . 10.0 109.358 -173.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 22.0 m-70 -74.13 -14.77 61.02 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 114.825 1.417 . . . . 10.0 114.825 -171.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 27.6 t -70.24 -43.99 69.44 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.434 0.693 . . . . 10.0 110.408 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 25.5 mmt -114.64 -40.42 3.58 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.271 1.428 . . . . 10.0 112.247 -175.422 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.21 61.67 1.13 Allowed Glycine 0 CA--C 1.535 1.322 0 C-N-CA 125.737 1.637 . . . . 10.0 112.682 -178.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 94.0 t -82.65 -56.53 5.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-O 121.631 0.729 . . . . 10.0 111.991 -175.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.97 30.79 0.44 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.909 0.884 . . . . 10.0 111.211 177.058 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 65.83 18.41 66.32 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 124.026 0.822 . . . . 10.0 113.195 -172.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -63.23 142.88 97.79 Favored Pre-proline 0 CA--C 1.539 0.536 0 O-C-N 121.681 -0.894 . . . . 10.0 111.676 179.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 91.7 Cg_endo -75.27 149.38 35.55 Favored 'Trans proline' 0 N--CA 1.452 -0.938 0 C-N-CA 122.841 2.361 . . . . 10.0 111.182 -172.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.2 mttt -63.58 134.5 55.6 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 116.041 -0.527 . . . . 10.0 112.34 -175.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 82.1 p -48.08 -22.96 0.7 Allowed 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.079 1.752 . . . . 10.0 114.453 173.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.76 40.14 1.84 Allowed 'General case' 0 CA--C 1.538 0.487 0 CA-C-N 119.135 0.879 . . . . 10.0 113.125 179.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -77.09 151.36 35.48 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.524 -0.735 . . . . 10.0 110.607 169.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.3 m -107.51 -30.57 8.56 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 122.704 0.402 . . . . 10.0 110.978 165.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.63 -36.58 70.78 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.945 -1.097 . . . . 10.0 113.179 -178.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -79.23 -30.18 43.09 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-O 121.91 0.862 . . . . 10.0 110.281 179.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 29.9 m95 -82.48 -31.56 29.28 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.967 1.707 . . . . 10.0 111.751 178.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -40.7 -62.04 1.08 Allowed Pre-proline 0 CA--C 1.545 0.753 0 C-N-CA 125.07 1.348 . . . . 10.0 113.954 172.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 93.9 Cg_endo -72.17 6.66 2.08 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 122.851 2.367 . . . . 10.0 113.787 179.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.482 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 29.2 mmt180 -108.49 -42.63 4.51 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.18 1.392 . . . . 10.0 109.345 177.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.05 6.12 2.32 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.081 1.752 . . . . 10.0 112.823 176.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.19 -34.96 37.01 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.53 1.532 . . . . 10.0 109.205 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.8 mtmt -80.92 -61.01 2.09 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.379 -0.373 . . . . 10.0 111.3 170.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 150.17 -127.94 2.54 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 111.428 -0.669 . . . . 10.0 111.428 175.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.9 m -122.42 172.77 9.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 126.331 1.852 . . . . 10.0 109.172 175.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 63.15 9.5 3.95 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.838 1.255 . . . . 10.0 113.832 -176.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -92.63 -62.14 1.45 Allowed 'General case' 0 C--N 1.343 0.295 0 CA-C-O 122.419 1.104 . . . . 10.0 108.913 170.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.66 -26.66 60.01 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 123.734 0.814 . . . . 10.0 111.468 -172.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -62.01 -29.43 46.43 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 O-C-N 121.611 -0.681 . . . . 10.0 110.371 173.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.7 mmpt? -69.28 -43.0 74.76 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.538 -0.727 . . . . 10.0 110.976 176.109 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -64.64 -39.09 93.08 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.507 -0.746 . . . . 10.0 109.939 176.196 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.431 HG12 ' CZ ' ' A' ' 67' ' ' TYR . 2.4 t -56.12 -48.55 78.94 Favored 'Isoleucine or valine' 0 C--O 1.235 0.315 0 CA-C-O 121.407 0.623 . . . . 10.0 111.85 178.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.97 -32.01 72.97 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 116.182 -0.463 . . . . 10.0 111.896 177.2 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 54.6 m -74.47 -29.66 61.54 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.083 0.953 . . . . 10.0 113.547 175.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.29 117.98 0.35 Allowed Glycine 0 CA--C 1.529 0.962 0 CA-C-N 119.306 0.957 . . . . 10.0 111.496 -170.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.6 tp -72.56 -145.3 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.139 0 C-N-CA 124.162 0.985 . . . . 10.0 110.628 168.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -80.64 -67.24 0.79 Allowed 'General case' 0 N--CA 1.477 0.893 0 O-C-N 119.648 -1.907 . . . . 10.0 111.301 -174.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -76.2 -14.74 60.14 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.276 1.43 . . . . 10.0 111.381 176.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.7 ttp -97.67 120.44 60.48 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 123.726 0.81 . . . . 10.0 110.862 -175.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -70.74 157.22 59.11 Favored 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 121.718 1.612 . . . . 10.0 111.31 -175.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -62.49 116.88 3.8 Favored 'Trans proline' 0 N--CA 1.456 -0.713 0 C-N-CA 123.031 2.488 . . . . 10.0 110.23 -179.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 98.49 35.91 4.78 Favored Glycine 0 C--N 1.344 1.018 0 CA-C-N 118.058 0.39 . . . . 10.0 113.104 -176.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 53.39 -86.66 0.01 OUTLIER Glycine 0 CA--C 1.537 1.425 0 C-N-CA 124.533 1.063 . . . . 10.0 113.998 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.6 ttt -171.98 40.16 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 127.242 2.217 . . . . 10.0 110.226 172.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.8 p -131.29 170.76 14.17 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.56 1.319 . . . . 10.0 114.56 -178.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 55.3 m -81.99 -98.77 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.928 1.291 . . . . 10.0 109.966 175.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 92.5 m-20 -82.35 64.29 6.94 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 120.957 -1.089 . . . . 10.0 109.434 -179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 4.2 m -60.75 86.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.807 0 CA-C-O 121.301 0.572 . . . . 10.0 111.495 176.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 6.3 p -78.23 132.27 37.48 Favored 'General case' 0 N--CA 1.454 -0.268 0 O-C-N 120.776 -1.203 . . . . 10.0 108.186 -178.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -46.77 -32.04 3.4 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.966 0.906 . . . . 10.0 112.515 178.049 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -52.72 -59.48 4.43 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.327 1.451 . . . . 10.0 113.968 166.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -73.89 -36.07 64.75 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 107.932 -1.136 . . . . 10.0 107.932 -175.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.431 ' CZ ' HG12 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -55.92 -60.24 3.75 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 123.165 0.586 . . . . 10.0 111.064 172.618 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 16.8 ptmt -57.82 -48.32 80.09 Favored 'General case' 0 N--CA 1.464 0.245 0 C-N-CA 124.338 1.055 . . . . 10.0 109.873 -177.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.94 -22.25 14.42 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 112.758 0.651 . . . . 10.0 112.758 172.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -101.79 -9.82 20.46 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 124.701 1.2 . . . . 10.0 113.859 -174.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.412 HG22 ' O ' ' A' ' 67' ' ' TYR . 0.0 OUTLIER -99.94 -38.76 6.87 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.962 0.905 . . . . 10.0 109.809 167.36 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -37.93 77.36 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.322 0.649 . . . . 10.0 111.698 175.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -49.93 -38.56 36.85 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.015 0.926 . . . . 10.0 112.462 176.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.7 mpp? -79.35 -65.17 1.03 Allowed 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 122.625 0.37 . . . . 10.0 111.991 179.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 t -164.3 27.94 0.07 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 119.451 -0.9 . . . . 10.0 112.917 -179.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 16.7 ptmt 40.0 46.81 1.84 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.784 0.834 . . . . 10.0 113.134 -175.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.482 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -132.64 -84.66 0.47 Allowed 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.887 1.275 . . . . 10.0 113.435 173.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.277 0 N-CA-C 115.651 1.722 . . . . 10.0 115.651 -164.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.904 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.211 0 CA-C-O 121.126 0.488 . . . . 10.0 110.134 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -178.6 115.13 0.07 Allowed 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 106.969 -1.493 . . . . 10.0 106.969 -156.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . 0.411 ' HA ' HD11 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -145.79 32.86 1.03 Allowed 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 113.325 0.861 . . . . 10.0 113.325 -177.148 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 8.4 mp0 -97.3 -25.27 15.31 Favored 'General case' 0 C--N 1.333 -0.135 0 C-N-CA 123.209 0.604 . . . . 10.0 112.144 -176.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -141.62 123.38 15.22 Favored 'General case' 0 N--CA 1.445 -0.688 0 N-CA-C 108.636 -0.876 . . . . 10.0 108.636 178.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -54.1 -36.1 62.84 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 124.134 0.974 . . . . 10.0 112.679 172.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -59.04 -47.41 85.34 Favored 'General case' 0 C--N 1.34 0.17 0 N-CA-C 110.426 -0.212 . . . . 10.0 110.426 170.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.78 -34.33 76.58 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.743 -0.598 . . . . 10.0 110.621 -178.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.411 HD11 ' HA ' ' A' ' -1' ' ' LEU . 33.8 mt -64.37 -51.61 66.04 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.193 0 N-CA-C 108.428 -0.952 . . . . 10.0 108.428 178.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.492 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -69.29 -42.3 75.66 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 117.695 -1.602 . . . . 10.0 112.294 -179.757 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -68.86 -22.48 64.2 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.641 1.576 . . . . 10.0 112.752 -176.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 1.4 ttpt -94.78 -28.8 15.09 Favored 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 112.95 0.722 . . . . 10.0 112.95 170.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.512 ' O ' HMC3 ' A' ' 90' ' ' HEC . . . -108.11 -64.94 1.16 Allowed 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 124.052 0.941 . . . . 10.0 112.562 -171.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.42 44.16 0.34 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.742 1.217 . . . . 10.0 110.483 179.278 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.5 t -129.8 -6.32 4.55 Favored 'General case' 0 N--CA 1.463 0.18 0 C-N-CA 124.883 1.273 . . . . 10.0 113.794 -164.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.6 t -97.11 -46.74 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 C-N-CA 124.779 1.231 . . . . 10.0 108.236 -176.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 82.3 m -92.07 -63.68 1.21 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 127.582 2.353 . . . . 10.0 110.507 -176.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 38.9 m-70 -73.61 -20.92 60.46 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 113.961 1.097 . . . . 10.0 113.961 -167.448 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 28.8 t -57.82 -53.59 56.46 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.505 1.122 . . . . 10.0 111.394 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.0 tpt -108.91 -12.78 14.84 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.768 0.827 . . . . 10.0 112.422 -178.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.42 40.84 7.64 Favored Glycine 0 CA--C 1.534 1.224 0 C-N-CA 124.266 0.936 . . . . 10.0 112.264 -175.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 68.8 t -80.08 155.91 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 124.469 1.108 . . . . 10.0 109.149 176.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 55.6 21.63 4.65 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.772 1.229 . . . . 10.0 113.619 -176.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.87 20.52 76.02 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 124.231 0.919 . . . . 10.0 113.842 -176.473 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -73.83 141.77 79.22 Favored Pre-proline 0 CA--C 1.547 0.856 0 CA-C-N 118.64 1.22 . . . . 10.0 113.681 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.31 132.7 13.97 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 124.763 3.642 . . . . 10.0 111.815 -176.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -61.49 142.77 56.8 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.705 -1.247 . . . . 10.0 113.835 -161.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 20.0 m -50.83 -33.59 24.27 Favored 'General case' 0 CA--C 1.536 0.428 0 N-CA-C 113.347 0.869 . . . . 10.0 113.347 176.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -125.63 117.61 23.9 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.248 1.019 . . . . 10.0 108.698 167.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -151.8 163.55 38.94 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 126.278 1.831 . . . . 10.0 106.838 172.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 96.5 m -110.08 -36.6 5.81 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-N 118.45 0.568 . . . . 10.0 111.138 170.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.95 -19.61 34.34 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.501 -0.749 . . . . 10.0 113.02 -175.562 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -83.09 -34.08 26.22 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.279 1.432 . . . . 10.0 110.283 178.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.431 ' CZ2' ' HE2' ' A' ' 78' ' ' LYS . 63.7 m95 -82.24 -40.73 21.2 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 126.233 1.813 . . . . 10.0 111.624 176.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -39.49 -60.11 1.39 Allowed Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 114.496 1.295 . . . . 10.0 114.496 175.099 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -65.04 -8.3 17.87 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.389 2.726 . . . . 10.0 114.151 -177.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -95.77 -53.48 3.69 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 123.845 0.858 . . . . 10.0 110.152 170.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -54.47 -18.88 4.76 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 125.641 1.577 . . . . 10.0 113.394 178.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.63 -32.81 36.14 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 125.637 1.575 . . . . 10.0 109.993 -176.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -83.54 -46.65 12.18 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 108.876 -0.787 . . . . 10.0 108.876 174.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.446 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 163.88 -142.82 8.09 Favored Glycine 0 CA--C 1.531 1.032 0 N-CA-C 110.892 -0.883 . . . . 10.0 110.892 -179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.4 t -134.63 -56.27 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.278 0 CA-C-O 122.707 1.241 . . . . 10.0 109.673 -174.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -52.67 -29.86 28.76 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 127.167 2.187 . . . . 10.0 111.232 179.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.446 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -55.92 -20.12 14.8 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.421 1.888 . . . . 10.0 113.916 175.3 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -103.13 -43.53 5.45 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.844 0.858 . . . . 10.0 111.061 -175.184 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.4 p -53.69 -34.07 23.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 CA-C-N 118.119 0.418 . . . . 10.0 111.185 171.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 ptmt -59.29 -48.55 81.21 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 114.099 1.148 . . . . 10.0 114.099 167.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.9 m -62.86 -35.14 79.0 Favored 'General case' 0 CA--C 1.531 0.213 0 O-C-N 120.617 -1.302 . . . . 10.0 110.152 -179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 28.5 t -58.04 -54.18 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.381 0 CA-C-N 116.349 -0.387 . . . . 10.0 111.055 173.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 1.5 ptmt -61.83 -33.74 74.7 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.573 0.582 . . . . 10.0 112.573 178.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 97.6 m -72.01 -33.54 68.14 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.48 0.712 . . . . 10.0 112.37 -178.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 81.54 98.34 0.42 Allowed Glycine 0 CA--C 1.531 1.08 0 CA-C-N 118.809 0.731 . . . . 10.0 111.929 -173.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 5.0 tp -67.48 170.13 8.01 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.279 1.031 . . . . 10.0 111.106 174.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.474 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 6.7 m-80 -52.68 -57.65 9.38 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 120.736 -1.228 . . . . 10.0 112.365 -171.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.32 20.9 9.74 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 125.33 1.452 . . . . 10.0 112.383 172.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 40.3 ttp -125.6 125.34 25.01 Favored Pre-proline 0 CA--C 1.548 0.894 0 N-CA-C 114.001 1.112 . . . . 10.0 114.001 172.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -61.87 151.22 82.44 Favored 'Trans proline' 0 CA--C 1.542 0.887 0 C-N-CA 121.868 1.712 . . . . 10.0 111.925 178.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -61.57 140.15 85.36 Favored 'Trans proline' 0 N--CA 1.456 -0.702 0 C-N-CA 123.171 2.58 . . . . 10.0 110.677 -177.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.75 30.76 73.43 Favored Glycine 0 CA--C 1.53 1.008 0 CA-C-N 116.502 -0.317 . . . . 10.0 112.734 -170.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.51 36.27 5.93 Favored Glycine 0 CA--C 1.536 1.396 0 O-C-N 121.693 -0.886 . . . . 10.0 114.314 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.2 ttt 84.93 12.41 0.26 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 126.936 2.094 . . . . 10.0 114.685 179.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 7.7 m -106.35 167.52 9.78 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 124.594 1.158 . . . . 10.0 112.338 171.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.1 m -131.19 -49.48 1.01 Allowed 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.882 1.673 . . . . 10.0 110.167 171.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -79.43 -29.77 42.02 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.414 1.486 . . . . 10.0 112.693 -175.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 21.9 m -55.21 122.29 10.73 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 126.108 1.763 . . . . 10.0 111.197 179.25 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 20.0 m -103.0 162.22 13.12 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.55 1.94 . . . . 10.0 109.539 -176.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -44.98 -44.77 10.14 Favored 'General case' 0 CA--C 1.541 0.612 0 O-C-N 120.788 -1.195 . . . . 10.0 113.627 176.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -50.0 -40.11 43.34 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.838 0.855 . . . . 10.0 112.248 174.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.402 ' HB3' ' CD1' ' A' ' 6' ' ' ILE . 0.4 OUTLIER -84.46 -44.08 14.0 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.619 0.767 . . . . 10.0 111.154 178.239 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -58.03 -50.2 74.23 Favored 'General case' 0 N--CA 1.469 0.481 0 O-C-N 120.895 -1.128 . . . . 10.0 112.285 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 21.3 mttm -58.41 -46.52 86.29 Favored 'General case' 0 N--CA 1.463 0.216 0 O-C-N 121.783 -0.573 . . . . 10.0 110.027 179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.5 -34.34 64.52 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 121.923 0.868 . . . . 10.0 112.858 170.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -73.34 -41.28 63.65 Favored 'General case' 0 CA--C 1.535 0.381 0 O-C-N 120.222 -1.549 . . . . 10.0 111.456 -178.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.2 pt -75.69 -33.13 25.66 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 O-C-N 121.646 -0.659 . . . . 10.0 112.634 175.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -69.86 -32.69 71.2 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 121.566 -0.709 . . . . 10.0 111.206 174.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.9 t80 -48.51 -48.34 38.22 Favored 'General case' 0 C--N 1.347 0.471 0 CA-C-N 119.092 0.86 . . . . 10.0 111.167 172.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.413 ' HB3' ' CZ2' ' A' ' 31' ' ' TRP . 73.3 mtm -71.76 -51.82 20.76 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 115.748 -0.66 . . . . 10.0 112.152 179.409 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -154.15 -79.29 0.1 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 117.595 0.18 . . . . 10.0 111.317 173.318 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 161.48 47.05 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 128.595 2.758 . . . . 10.0 110.68 -176.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.2 -88.58 0.03 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 N-CA-C 113.478 0.918 . . . . 10.0 113.478 175.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.431 ' HE2' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.136 0 N-CA-C 115.205 1.557 . . . . 10.0 115.205 -172.061 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.836 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.988 0 CA-C-O 118.27 -0.871 . . . . 10.0 109.533 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -159.89 126.53 4.4 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 108.815 -0.809 . . . . 10.0 108.815 -149.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . 0.54 ' HA ' HD11 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -74.54 57.64 0.73 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.761 0.824 . . . . 10.0 113.06 -175.072 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -102.26 -21.49 14.33 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 114.036 1.125 . . . . 10.0 114.036 -170.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.45 ' O ' HD13 ' A' ' 6' ' ' ILE . 47.4 t0 -143.5 -164.2 1.81 Allowed 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 126.775 2.03 . . . . 10.0 107.193 -174.034 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -108.75 -44.26 4.07 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 127.29 2.236 . . . . 10.0 111.664 172.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -58.84 -48.35 81.65 Favored 'General case' 0 CA--C 1.53 0.184 0 O-C-N 121.941 -0.474 . . . . 10.0 111.649 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.44 -28.61 68.74 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.336 -0.852 . . . . 10.0 110.96 -177.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.54 HD11 ' HA ' ' A' ' -1' ' ' LEU . 1.4 mp -69.24 -51.65 41.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.371 0 N-CA-C 108.128 -1.064 . . . . 10.0 108.128 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.431 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.4 OUTLIER -68.34 -41.95 79.99 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 118.026 -1.47 . . . . 10.0 111.747 177.093 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -67.97 -22.11 65.04 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.956 1.702 . . . . 10.0 112.778 -176.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.58 -28.42 16.04 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 113.838 1.051 . . . . 10.0 113.838 167.383 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.444 ' O ' HMC3 ' A' ' 90' ' ' HEC . . . -105.73 -67.77 0.91 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 124.131 0.972 . . . . 10.0 112.057 -171.051 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.431 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.04 41.86 0.3 Allowed 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 125.251 1.42 . . . . 10.0 110.365 -179.029 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -128.46 -7.11 5.23 Favored 'General case' 0 CA--C 1.52 -0.177 0 C-N-CA 125.657 1.583 . . . . 10.0 113.283 -167.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 10.2 t -94.52 -39.97 10.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 C-N-CA 124.134 0.973 . . . . 10.0 108.54 -176.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.7 m -106.93 -55.71 2.29 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.779 1.632 . . . . 10.0 110.629 -172.055 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.445 ' CE1' ' HG2' ' A' ' 23' ' ' PRO . 20.0 m-70 -75.19 -19.67 59.69 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.665 1.357 . . . . 10.0 114.665 -172.482 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 2.9 m -65.45 -51.64 58.76 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.464 0.705 . . . . 10.0 110.237 178.608 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -98.71 -34.59 10.47 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.092 1.357 . . . . 10.0 111.595 -177.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 98.09 57.74 1.0 Allowed Glycine 0 CA--C 1.537 1.451 0 C-N-CA 126.296 1.903 . . . . 10.0 112.508 -174.161 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 18.5 t -94.9 153.68 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 C-N-CA 124.769 1.227 . . . . 10.0 110.435 179.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.09 20.84 5.85 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.241 1.416 . . . . 10.0 113.528 -177.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.9 22.31 69.27 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 124.561 1.077 . . . . 10.0 113.571 -173.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.69 143.14 94.69 Favored Pre-proline 0 CA--C 1.541 0.599 0 CA-C-N 118.516 1.158 . . . . 10.0 112.606 179.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.445 ' HG2' ' CE1' ' A' ' 15' ' ' HIS . 96.4 Cg_endo -74.22 146.99 36.93 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 124.776 3.651 . . . . 10.0 110.571 -179.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 7.5 tttt -74.54 135.45 42.15 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 121.812 -0.555 . . . . 10.0 111.657 -167.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.66 -34.12 4.81 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.651 1.18 . . . . 10.0 113.472 178.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 48.8 p-80 -125.32 103.57 8.0 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.803 1.641 . . . . 10.0 108.971 170.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.8 m-20 -141.24 161.8 37.02 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 107.182 -1.414 . . . . 10.0 107.182 170.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 59.7 m -109.94 -35.6 6.1 Favored 'General case' 0 N--CA 1.471 0.607 0 CA-C-N 118.408 0.549 . . . . 10.0 111.35 171.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.48 -12.65 45.38 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.295 -0.878 . . . . 10.0 113.293 -177.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.446 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 13.7 t0 -88.58 -25.77 22.31 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.641 1.576 . . . . 10.0 109.898 174.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.467 ' CZ3' ' OXT' ' A' ' 78' ' ' LYS . 63.4 m95 -96.68 -35.06 11.15 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.719 1.608 . . . . 10.0 111.095 -179.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.07 -52.64 19.14 Favored Pre-proline 0 CA--C 1.549 0.941 0 N-CA-C 114.694 1.368 . . . . 10.0 114.694 169.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 87.6 Cg_endo -74.83 16.18 0.66 Allowed 'Trans proline' 0 CA--C 1.54 0.816 0 C-N-CA 122.933 2.422 . . . . 10.0 113.641 -179.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 2.2 mmt180 -122.07 -45.05 2.26 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.78 2.032 . . . . 10.0 108.827 176.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.519 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.3 OUTLIER -59.41 0.96 0.09 Allowed 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 126.054 1.742 . . . . 10.0 114.433 166.877 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -81.11 -27.08 35.71 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.98 1.312 . . . . 10.0 109.842 174.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -90.42 -57.08 2.96 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.4 0.68 . . . . 10.0 110.492 173.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 148.9 -115.69 0.75 Allowed Glycine 0 CA--C 1.531 1.083 0 C-N-CA 123.845 0.736 . . . . 10.0 111.279 174.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -129.52 173.79 13.47 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.163 0 C-N-CA 125.064 1.346 . . . . 10.0 110.893 171.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.258 16.0 m-20 69.3 -27.51 0.16 Allowed 'General case' 0 CA--C 1.559 1.32 0 C-N-CA 125.48 1.512 . . . . 10.0 112.877 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -63.67 -26.86 68.86 Favored 'General case' 0 N--CA 1.468 0.465 0 O-C-N 120.014 -1.678 . . . . 10.0 113.859 179.125 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -99.55 -38.51 8.73 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.623 0.769 . . . . 10.0 111.07 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -54.52 -33.99 27.99 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 122.015 -0.428 . . . . 10.0 110.25 172.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 ptmt -59.11 -46.97 86.96 Favored 'General case' 0 CA--C 1.54 0.595 0 N-CA-C 113.916 1.08 . . . . 10.0 113.916 169.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 55.5 m -68.53 -28.38 66.93 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 120.59 -1.319 . . . . 10.0 110.547 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 24.3 t -60.24 -54.06 40.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 O-C-N 121.657 -0.652 . . . . 10.0 111.481 170.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 -33.84 73.5 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 111.951 0.352 . . . . 10.0 111.951 177.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.03 -35.39 66.76 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 112.514 0.561 . . . . 10.0 112.514 -178.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 78.74 112.67 0.21 Allowed Glycine 0 CA--C 1.527 0.838 0 N-CA-C 111.255 -0.738 . . . . 10.0 111.255 -167.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.6 -155.23 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.578 0.751 . . . . 10.0 110.523 170.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -73.13 -66.58 0.66 Allowed 'General case' 0 N--CA 1.475 0.802 0 O-C-N 119.67 -1.894 . . . . 10.0 111.608 -173.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -73.31 -16.51 61.37 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.508 1.123 . . . . 10.0 112.118 174.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.2 ttp -100.77 118.05 61.45 Favored Pre-proline 0 CA--C 1.541 0.631 0 C-N-CA 123.237 0.615 . . . . 10.0 111.826 -172.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -69.02 154.3 70.92 Favored 'Trans proline' 0 CA--C 1.54 0.8 0 C-N-CA 122.115 1.876 . . . . 10.0 111.926 -173.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -59.58 124.8 16.22 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 123.991 3.127 . . . . 10.0 110.973 -177.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 81.89 43.03 8.49 Favored Glycine 0 C--N 1.34 0.793 0 CA-C-O 118.954 -0.914 . . . . 10.0 111.249 -172.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 17.6 57.73 0.01 OUTLIER Glycine 0 CA--C 1.531 1.088 0 C-N-CA 126.976 2.227 . . . . 10.0 115.422 -179.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.656 ' HB2' HMC2 ' A' ' 90' ' ' HEC . 0.0 OUTLIER 72.34 -51.98 0.7 Allowed 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.003 1.321 . . . . 10.0 112.972 -172.759 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.6 p -79.63 87.57 5.18 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.808 1.04 . . . . 10.0 113.808 173.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 68.3 p -55.79 -50.07 71.47 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.399 -0.813 . . . . 10.0 111.124 171.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -78.32 63.24 3.16 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.824 1.65 . . . . 10.0 110.166 178.72 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 2.9 m -131.12 122.84 27.38 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.863 1.265 . . . . 10.0 111.073 174.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.0 m -90.83 141.72 28.52 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 124.765 1.226 . . . . 10.0 109.368 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -43.07 -38.18 2.25 Favored 'General case' 0 CA--C 1.543 0.673 0 N-CA-C 114.32 1.23 . . . . 10.0 114.32 177.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -47.81 -58.52 4.25 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.225 1.01 . . . . 10.0 112.417 169.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -74.52 -40.87 61.48 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 124.901 1.281 . . . . 10.0 110.168 -178.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -57.09 14.08 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 124.024 0.929 . . . . 10.0 109.811 178.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -51.53 68.28 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 124.688 1.195 . . . . 10.0 110.036 -177.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -53.4 -33.76 55.08 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.354 -0.841 . . . . 10.0 112.709 170.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.58 -31.73 47.35 Favored 'General case' 0 C--N 1.341 0.222 0 O-C-N 121.013 -1.055 . . . . 10.0 111.487 -175.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.489 HG12 ' OXT' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -78.81 -50.42 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.959 0 CA-C-O 121.775 0.797 . . . . 10.0 109.471 173.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -53.68 -31.71 48.88 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 125.203 1.401 . . . . 10.0 112.17 176.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 52.9 t80 -49.82 -58.08 6.09 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 124.568 1.147 . . . . 10.0 112.197 172.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.431 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 4.9 mpp? -64.17 -57.05 10.68 Favored 'General case' 0 C--N 1.34 0.194 0 N-CA-C 109.358 -0.608 . . . . 10.0 109.358 177.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -177.09 129.45 0.17 Allowed 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 107.519 -1.289 . . . . 10.0 107.519 174.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.02 74.16 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.587 1.955 . . . . 10.0 113.185 172.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.519 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -163.99 -65.4 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.484 1.514 . . . . 10.0 113.757 -171.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.489 ' OXT' HG12 ' A' ' 71' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.712 0 N-CA-C 116.006 1.854 . . . . 10.0 116.006 -165.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.9 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.202 0 CA-C-O 120.486 0.184 . . . . 10.0 111.289 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -168.88 126.28 1.0 Allowed 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.155 0.982 . . . . 10.0 108.645 -167.162 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -77.81 68.01 3.79 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 121.766 0.793 . . . . 10.0 110.218 175.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -113.52 -22.38 10.35 Favored 'General case' 0 N--CA 1.466 0.329 0 C-N-CA 125.216 1.406 . . . . 10.0 114.123 176.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 43.0 t0 -146.97 117.37 7.43 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.684 -0.858 . . . . 10.0 108.684 -177.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -45.2 -40.58 7.41 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.529 1.131 . . . . 10.0 113.743 173.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -60.48 -49.64 76.74 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.356 -0.215 . . . . 10.0 110.667 172.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.55 -30.69 70.4 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.557 -0.715 . . . . 10.0 111.303 -177.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 15.8 mt -66.73 -52.79 41.39 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 N-CA-C 108.694 -0.854 . . . . 10.0 108.694 176.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.437 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.3 OUTLIER -68.56 -40.92 80.43 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 117.921 -1.511 . . . . 10.0 111.16 -179.372 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -69.04 -21.95 64.08 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 126.041 1.737 . . . . 10.0 113.273 -178.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -94.14 -29.08 15.33 Favored 'General case' 0 CA--C 1.546 0.816 0 O-C-N 121.21 -0.931 . . . . 10.0 113.172 168.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.72 -66.72 1.01 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.356 1.062 . . . . 10.0 112.78 -171.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.437 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.04 39.64 0.19 Allowed 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.116 1.366 . . . . 10.0 110.757 179.169 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.6 t -125.12 3.37 7.92 Favored 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.797 1.239 . . . . 10.0 113.62 -167.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.3 t -105.84 -52.55 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 124.71 1.204 . . . . 10.0 108.249 -174.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 27.5 m -84.49 -62.53 1.53 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 125.559 1.544 . . . . 10.0 111.08 176.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 72.4 m-70 -73.92 -23.87 59.6 Favored 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 114.943 1.46 . . . . 10.0 114.943 -167.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.42 -46.78 87.76 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 123.152 0.581 . . . . 10.0 110.456 -179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -109.51 -22.21 12.1 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 123.847 0.859 . . . . 10.0 111.871 -176.481 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.46 57.34 1.88 Allowed Glycine 0 CA--C 1.535 1.284 0 C-N-CA 124.032 0.825 . . . . 10.0 112.019 -175.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 46.4 t -103.34 161.24 4.32 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 125.375 1.47 . . . . 10.0 109.396 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.33 22.05 10.38 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 124.089 0.956 . . . . 10.0 113.163 -175.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 73.69 16.4 79.17 Favored Glycine 0 CA--C 1.536 1.345 0 C-N-CA 124.157 0.884 . . . . 10.0 113.199 -173.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.15 144.18 98.15 Favored Pre-proline 0 CA--C 1.543 0.699 0 CA-C-N 118.262 1.031 . . . . 10.0 113.366 -174.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -76.28 139.1 20.75 Favored 'Trans proline' 0 N--CA 1.455 -0.767 0 C-N-CA 124.249 3.299 . . . . 10.0 111.015 -176.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.0 mttt -62.54 143.81 56.79 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.524 0.564 . . . . 10.0 112.524 -165.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.2 t -49.14 -35.29 16.19 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.436 1.094 . . . . 10.0 113.511 177.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.2 p-80 -142.01 57.78 1.48 Allowed 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.829 0.852 . . . . 10.0 112.277 178.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -79.35 165.46 23.11 Favored 'General case' 0 CA--C 1.541 0.63 0 N-CA-C 108.913 -0.773 . . . . 10.0 108.913 165.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.2 p -107.95 -35.91 6.5 Favored 'General case' 0 C--O 1.222 -0.377 0 O-C-N 121.67 -0.643 . . . . 10.0 111.417 164.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.06 -22.01 56.13 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 120.557 -1.34 . . . . 10.0 113.203 -176.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -87.78 -23.4 24.08 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 127.396 2.278 . . . . 10.0 110.259 -178.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.537 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 43.7 m95 -97.28 -36.8 10.29 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 126.053 1.741 . . . . 10.0 110.776 178.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 14.3 mt-10 -41.64 -59.79 2.26 Favored Pre-proline 0 CA--C 1.544 0.718 0 C-N-CA 125.27 1.428 . . . . 10.0 114.037 174.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -64.04 -10.87 24.75 Favored 'Trans proline' 0 CA--C 1.538 0.715 0 C-N-CA 122.613 2.209 . . . . 10.0 113.833 -179.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.9 mpt_? -96.43 -47.77 5.84 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.506 1.122 . . . . 10.0 110.084 176.402 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -65.89 -17.58 64.75 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.442 1.897 . . . . 10.0 112.407 179.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -82.36 -38.05 24.77 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 125.026 1.33 . . . . 10.0 109.097 -179.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.3 mmtt -68.01 -49.76 59.61 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.58 -0.736 . . . . 10.0 110.534 171.211 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 162.59 -132.9 2.91 Favored Glycine 0 CA--C 1.53 1.028 0 N-CA-C 112.142 -0.383 . . . . 10.0 112.142 178.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.3 t -137.86 -54.02 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 C-N-CA 123.875 0.87 . . . . 10.0 109.975 179.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -74.38 34.5 0.09 Allowed 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.456 1.502 . . . . 10.0 113.251 -177.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.512 ' HB2' HD22 ' A' ' 42' ' ' LEU . 2.4 m-20 -111.08 -54.74 2.57 Favored 'General case' 0 N--CA 1.447 -0.597 0 C-N-CA 127.762 2.425 . . . . 10.0 106.27 -179.141 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.512 HD22 ' HB2' ' A' ' 41' ' ' ASN . 4.0 mm? -77.15 -32.52 56.35 Favored 'General case' 0 N--CA 1.451 -0.376 0 O-C-N 121.481 -0.762 . . . . 10.0 110.552 -175.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -63.95 -15.3 16.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 O-C-N 121.929 -0.482 . . . . 10.0 111.566 171.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.4 mmpt? -85.96 -49.11 8.1 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.421 0.688 . . . . 10.0 111.102 168.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.8 m -58.59 -38.87 78.86 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 120.428 1.467 . . . . 10.0 110.64 179.063 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 2.7 p -62.0 -42.94 96.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.589 0 CA-C-O 121.425 0.631 . . . . 10.0 110.963 -178.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.8 -30.42 51.23 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.762 0.825 . . . . 10.0 111.922 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 53.4 m -74.63 -25.45 59.23 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.438 1.095 . . . . 10.0 112.618 176.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.97 115.16 0.34 Allowed Glycine 0 CA--C 1.529 0.912 0 CA-C-N 119.486 1.039 . . . . 10.0 111.99 -175.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.3 tp -105.77 -145.74 0.38 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.518 0.727 . . . . 10.0 111.008 177.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 5.0 m120 -80.27 141.66 35.32 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 122.566 1.175 . . . . 10.0 108.768 174.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . 55.72 22.09 5.16 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 112.183 -2.281 . . . . 10.0 111.953 173.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 7.6 ttp -144.64 123.3 6.84 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.516 1.127 . . . . 10.0 110.571 -174.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -72.45 148.39 48.29 Favored 'Trans proline' 0 CA--C 1.539 0.756 0 C-N-CA 121.881 1.721 . . . . 10.0 112.038 -173.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -62.95 113.66 2.1 Favored 'Trans proline' 0 N--CA 1.456 -0.692 0 C-N-CA 123.648 2.899 . . . . 10.0 110.189 -179.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 114.7 -10.6 21.31 Favored Glycine 0 CA--C 1.529 0.929 0 O-C-N 123.566 0.541 . . . . 10.0 112.668 -170.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 59.07 49.48 78.03 Favored Glycine 0 CA--C 1.534 1.234 0 O-C-N 120.429 -1.63 . . . . 10.0 109.999 -175.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 76.39 -45.54 0.51 Allowed 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.462 1.905 . . . . 10.0 112.812 -177.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 31.0 p -76.86 159.57 29.94 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.215 -0.928 . . . . 10.0 111.279 177.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 34.1 p -110.05 -69.43 0.86 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.315 1.046 . . . . 10.0 110.38 -177.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 38.5 t0 -78.87 54.68 1.6 Allowed 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.882 1.273 . . . . 10.0 110.602 -179.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -86.22 115.83 24.03 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.443 1.097 . . . . 10.0 111.086 -176.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 50.0 m -91.69 126.94 36.95 Favored 'General case' 0 C--O 1.231 0.09 0 N-CA-C 108.568 -0.901 . . . . 10.0 108.568 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -43.96 -34.4 1.68 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 125.299 1.439 . . . . 10.0 113.174 -178.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -43.81 -66.78 0.34 Allowed 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.464 1.105 . . . . 10.0 113.275 163.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -73.67 -29.24 62.2 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.329 -0.857 . . . . 10.0 110.081 -177.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.03 -52.62 64.19 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-O 121.807 0.813 . . . . 10.0 111.358 179.232 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -66.69 -47.1 73.49 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-O 117.804 -1.093 . . . . 10.0 109.296 176.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.15 -29.67 5.74 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 120.097 1.317 . . . . 10.0 113.524 171.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -84.24 -36.61 22.59 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 124.397 1.079 . . . . 10.0 112.131 -177.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 5.0 mt -81.63 -47.55 19.51 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 124.86 1.264 . . . . 10.0 111.8 176.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.25 -34.7 33.61 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 125.336 1.454 . . . . 10.0 112.443 172.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 35.5 t80 -44.24 -39.71 4.64 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.785 0.834 . . . . 10.0 112.523 173.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.537 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER -82.5 -70.43 0.55 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 122.771 0.428 . . . . 10.0 111.962 -178.456 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.5 t -161.34 32.48 0.14 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 123.674 0.79 . . . . 10.0 112.488 179.457 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.8 pttt 36.94 57.74 1.17 Allowed 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 125.457 1.503 . . . . 10.0 114.588 179.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -143.05 -52.65 0.37 Allowed 'General case' 0 C--O 1.222 -0.392 0 N-CA-C 113.841 1.052 . . . . 10.0 113.841 178.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.407 ' O ' ' NZ ' ' A' ' 78' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.246 0.911 0 C-N-CA 125.165 1.386 . . . . 10.0 113.443 -166.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.705 HMC1 ' CBC' ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.998 0 N-CA-C 108.097 -1.075 . . . . 10.0 108.097 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -163.46 126.54 2.67 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 108.261 -1.015 . . . . 10.0 108.261 176.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . 0.413 ' HA ' HD11 ' A' ' 6' ' ' ILE . 1.2 tm? -74.62 68.94 1.7 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-O 122.046 0.927 . . . . 10.0 110.516 176.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -114.48 -20.2 10.87 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.452 1.501 . . . . 10.0 114.165 -178.234 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 3' ' ' ALA . 15.6 t70 -144.47 -153.39 0.47 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.958 1.303 . . . . 10.0 108.321 -174.184 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.407 ' H ' ' CG ' ' A' ' 2' ' ' ASP . . . -127.82 -40.4 1.72 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 128.335 2.654 . . . . 10.0 111.443 177.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -56.49 -46.69 80.35 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.449 0.642 . . . . 10.0 110.47 175.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.96 -31.52 72.15 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 121.877 -0.514 . . . . 10.0 110.746 -178.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.413 HD11 ' HA ' ' A' ' -1' ' ' LEU . 1.3 mp -69.3 -52.34 34.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 N-CA-C 107.983 -1.117 . . . . 10.0 107.983 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.485 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -68.27 -39.47 82.15 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 118.181 -1.408 . . . . 10.0 111.325 -179.148 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -69.39 -22.83 63.68 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.204 1.402 . . . . 10.0 113.003 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -91.64 -30.98 16.04 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.667 0.988 . . . . 10.0 113.667 167.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.426 ' O ' HMC3 ' A' ' 90' ' ' HEC . . . -110.01 -64.89 1.21 Allowed 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.24 1.016 . . . . 10.0 111.946 -166.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.485 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.74 41.2 0.2 Allowed 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 124.627 1.171 . . . . 10.0 110.912 177.43 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.7 t -128.81 0.25 5.39 Favored 'General case' 0 N--CA 1.463 0.225 0 C-N-CA 125.66 1.584 . . . . 10.0 113.631 -166.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.5 t -101.97 -51.11 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 C-N-CA 124.62 1.168 . . . . 10.0 108.199 -176.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 64.6 m -88.67 -64.1 1.2 Allowed 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 126.119 1.768 . . . . 10.0 109.933 179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 49.3 m-70 -73.65 -11.19 60.34 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.05 1.5 . . . . 10.0 115.05 -166.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -74.35 -36.68 63.62 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.124 0.97 . . . . 10.0 110.908 178.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -125.23 -37.42 2.4 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.753 1.221 . . . . 10.0 112.24 -172.419 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.35 64.15 1.17 Allowed Glycine 0 CA--C 1.533 1.187 0 C-N-CA 125.75 1.643 . . . . 10.0 112.909 175.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 73.5 t -84.67 -56.66 5.23 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 123.657 0.783 . . . . 10.0 111.925 -176.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.1 33.23 0.44 Allowed 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.941 0.897 . . . . 10.0 111.128 177.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 63.59 21.8 65.25 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 124.497 1.046 . . . . 10.0 113.258 -174.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -62.97 137.95 97.14 Favored Pre-proline 0 CA--C 1.545 0.756 0 O-C-N 121.813 -0.816 . . . . 10.0 112.564 -174.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -70.08 135.55 29.96 Favored 'Trans proline' 0 N--CA 1.458 -0.617 0 C-N-CA 123.645 2.897 . . . . 10.0 110.3 -175.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 5.5 mtmm -53.58 133.62 41.26 Favored 'General case' 0 CA--C 1.538 0.495 0 O-C-N 121.155 -0.966 . . . . 10.0 112.578 -171.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 59.4 p -55.68 -14.16 2.07 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 113.824 1.046 . . . . 10.0 113.824 173.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.5 p-80 -145.82 45.65 1.27 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.436 1.094 . . . . 10.0 111.848 177.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.424 ' HB3' ' HB2' ' A' ' 30' ' ' ASP . 1.3 t-20 -76.64 167.95 20.94 Favored 'General case' 0 CA--C 1.541 0.599 0 O-C-N 121.407 -0.808 . . . . 10.0 109.82 166.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.7 t -109.15 -35.65 6.25 Favored 'General case' 0 N--CA 1.472 0.629 0 O-C-N 121.875 -0.516 . . . . 10.0 111.53 161.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.83 -21.14 51.94 Favored 'General case' 0 N--CA 1.468 0.47 0 O-C-N 120.181 -1.574 . . . . 10.0 113.345 -174.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.424 ' HB2' ' HB3' ' A' ' 27' ' ' ASN . 0.5 OUTLIER -82.77 -26.69 31.63 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.08 2.152 . . . . 10.0 110.006 177.063 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.493 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 41.0 m95 -94.5 -36.34 11.9 Favored 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 125.841 1.656 . . . . 10.0 110.846 -177.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -45.33 -56.78 8.66 Favored Pre-proline 0 CA--C 1.545 0.778 0 O-C-N 120.811 -1.181 . . . . 10.0 113.635 174.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -76.47 21.57 0.55 Allowed 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 123.167 2.578 . . . . 10.0 113.133 178.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.423 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 1.8 mmp_? -125.37 -47.98 1.71 Allowed 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 126.582 1.953 . . . . 10.0 109.02 175.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.18 -19.66 47.14 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 127.799 2.44 . . . . 10.0 112.036 173.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -80.41 -28.45 37.81 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 124.526 1.131 . . . . 10.0 110.124 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 14.6 mmmt -74.93 -51.26 14.23 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.465 -0.568 . . . . 10.0 109.465 174.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.5 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 158.3 -117.34 0.77 Allowed Glycine 0 CA--C 1.531 1.06 0 C-N-CA 124.686 1.136 . . . . 10.0 110.403 177.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -144.01 -56.64 0.15 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.344 0 C-N-CA 124.294 1.038 . . . . 10.0 110.764 177.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -68.49 17.17 0.04 OUTLIER 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.486 1.115 . . . . 10.0 113.371 -176.812 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.5 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -97.89 -22.97 16.04 Favored 'General case' 0 C--N 1.341 0.21 0 C-N-CA 125.754 1.621 . . . . 10.0 110.526 177.428 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -104.43 -43.14 5.26 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 124.338 1.055 . . . . 10.0 110.031 -175.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -54.36 -33.22 25.5 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 O-C-N 121.72 -0.613 . . . . 10.0 111.151 171.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt -63.68 -43.45 96.63 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.217 -0.927 . . . . 10.0 113.112 172.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.7 m -66.16 -34.15 77.4 Favored 'General case' 0 CA--C 1.529 0.162 0 O-C-N 121.203 -0.935 . . . . 10.0 110.371 177.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.414 ' HA ' ' HE3' ' A' ' 53' ' ' MET . 31.3 t -56.87 -54.86 24.32 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 122.491 0.317 . . . . 10.0 110.995 174.493 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.05 -35.08 68.91 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 112.952 0.723 . . . . 10.0 112.952 175.785 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 22.6 m -71.58 -36.13 70.78 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 123.05 0.54 . . . . 10.0 111.999 179.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.48 95.68 0.6 Allowed Glycine 0 CA--C 1.528 0.904 0 CA-C-N 118.862 0.756 . . . . 10.0 111.23 -174.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.1 tp -60.13 169.39 1.58 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 122.138 0.971 . . . . 10.0 111.839 173.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.51 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 13.7 m-80 -50.32 -55.95 13.35 Favored 'General case' 0 N--CA 1.47 0.572 0 O-C-N 120.71 -1.244 . . . . 10.0 112.603 -174.039 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -95.29 20.39 9.36 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 113.799 -1.546 . . . . 10.0 112.073 176.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.414 ' HE3' ' HA ' ' A' ' 46' ' ' VAL . 39.7 ttp -129.08 130.63 23.42 Favored Pre-proline 0 CA--C 1.551 1.019 0 N-CA-C 114.478 1.288 . . . . 10.0 114.478 175.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -64.02 157.43 53.1 Favored 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 121.992 1.794 . . . . 10.0 112.182 177.497 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -60.12 137.0 72.66 Favored 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 122.791 2.327 . . . . 10.0 110.118 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 62.16 27.9 69.8 Favored Glycine 0 CA--C 1.525 0.701 0 CA-C-O 118.927 -0.93 . . . . 10.0 113.756 -175.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 48.21 33.85 11.63 Favored Glycine 0 CA--C 1.533 1.182 0 C-N-CA 125.128 1.347 . . . . 10.0 113.782 -178.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 71.15 45.58 0.49 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.973 1.309 . . . . 10.0 112.077 -175.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.8 t -125.5 -52.6 1.6 Allowed 'General case' 0 CA--C 1.534 0.328 0 O-C-N 121.592 -0.693 . . . . 10.0 111.669 163.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.9 m 70.2 -69.47 0.17 Allowed 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.993 1.317 . . . . 10.0 110.818 -178.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -84.16 55.06 3.17 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.878 0.871 . . . . 10.0 110.699 178.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.3 m -114.65 140.56 48.73 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 125.354 1.462 . . . . 10.0 109.644 173.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 59.9 m -101.78 146.55 27.62 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 124.525 1.13 . . . . 10.0 109.492 175.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -41.92 -39.84 1.97 Allowed 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 115.063 1.505 . . . . 10.0 115.063 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -42.71 -63.59 0.76 Allowed 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 119.758 1.163 . . . . 10.0 112.607 167.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.82 -40.05 63.62 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 126.541 1.936 . . . . 10.0 109.613 -175.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.33 -59.12 5.83 Favored 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 123.923 0.889 . . . . 10.0 110.065 178.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt -59.16 -46.29 88.77 Favored 'General case' 0 C--O 1.222 -0.348 0 C-N-CA 124.525 1.13 . . . . 10.0 109.411 178.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.01 -26.48 37.28 Favored 'General case' 0 CA--C 1.545 0.76 0 O-C-N 121.3 -0.875 . . . . 10.0 112.415 174.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -88.85 -6.64 57.2 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 125.212 1.405 . . . . 10.0 112.648 -174.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.51 -40.27 4.91 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.505 0 C-N-CA 125.447 1.499 . . . . 10.0 110.335 167.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.81 -40.71 76.47 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 123.71 0.804 . . . . 10.0 111.108 175.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 54.0 t80 -52.64 -36.8 57.34 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.893 0.701 . . . . 10.0 112.893 176.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.493 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 2.6 mpp? -75.3 -66.03 0.82 Allowed 'General case' 0 N--CA 1.455 -0.219 0 O-C-N 121.819 -0.55 . . . . 10.0 111.562 177.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -166.53 35.37 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 119.569 -0.853 . . . . 10.0 112.519 -178.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt 37.29 51.65 1.13 Allowed 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.861 0.864 . . . . 10.0 113.301 -176.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.423 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -141.3 -82.93 0.21 Allowed 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 114.012 1.116 . . . . 10.0 114.012 170.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.984 0 N-CA-C 115.733 1.753 . . . . 10.0 115.733 -164.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.811 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.128 0 N-CA-C 113.0 0.741 . . . . 10.0 113.0 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -166.71 122.7 1.19 Allowed 'General case' 0 CA--C 1.539 0.537 0 N-CA-C 108.187 -1.042 . . . . 10.0 108.187 -178.366 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.56 38.81 0.12 Allowed 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 113.868 1.062 . . . . 10.0 113.868 -179.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.4 mm-40 -98.68 -26.23 14.44 Favored 'General case' 0 N--CA 1.461 0.11 0 O-C-N 121.298 -0.876 . . . . 10.0 113.081 -174.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -141.24 127.42 19.65 Favored 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.995 -1.113 . . . . 10.0 107.995 172.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.96 -36.99 75.75 Favored 'General case' 0 N--CA 1.444 -0.732 0 C-N-CA 123.965 0.906 . . . . 10.0 112.003 175.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -61.94 -48.41 80.53 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 120.401 -0.52 . . . . 10.0 110.934 172.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.08 -31.0 71.61 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 121.34 -0.85 . . . . 10.0 109.848 -177.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 4.6 mm -65.77 -52.78 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.472 0 CA-C-O 117.698 -1.144 . . . . 10.0 109.248 173.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.406 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.5 OUTLIER -68.17 -39.55 82.52 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 121.258 1.844 . . . . 10.0 112.153 -178.541 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -69.74 -22.32 63.38 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 127.288 2.235 . . . . 10.0 111.926 -176.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.89 -27.12 15.33 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 114.035 1.124 . . . . 10.0 114.035 166.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -104.98 -70.67 0.77 Allowed 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 125.131 1.372 . . . . 10.0 112.557 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.406 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.49 42.07 0.27 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.937 1.695 . . . . 10.0 110.418 -178.775 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.0 t -127.48 -5.49 5.91 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 125.172 1.389 . . . . 10.0 113.677 -164.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 42.1 t -95.87 -53.5 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.624 0 CA-C-O 122.311 1.053 . . . . 10.0 108.167 -175.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 29.2 m -93.04 -55.24 3.41 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.525 1.53 . . . . 10.0 109.261 -171.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -72.76 -19.8 61.3 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.677 1.191 . . . . 10.0 113.334 -172.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 46.9 t -63.62 -49.6 72.67 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 123.18 0.592 . . . . 10.0 110.879 -178.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.7 tpt -112.08 -27.21 8.48 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.332 1.053 . . . . 10.0 112.977 -177.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.64 58.62 2.01 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 124.781 1.181 . . . . 10.0 112.859 -177.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 96.2 t -82.63 -58.22 3.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.64 0 O-C-N 121.898 -0.766 . . . . 10.0 112.204 -175.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.55 32.01 0.41 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.873 0.869 . . . . 10.0 111.044 178.372 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 63.62 23.91 67.44 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 123.747 0.689 . . . . 10.0 112.832 -172.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.94 145.15 97.71 Favored Pre-proline 0 CA--C 1.544 0.731 0 O-C-N 121.769 -0.842 . . . . 10.0 111.142 176.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -73.94 144.86 35.01 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 123.73 2.953 . . . . 10.0 110.873 -174.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -65.53 138.31 57.97 Favored 'General case' 0 C--O 1.239 0.534 0 O-C-N 121.796 -0.565 . . . . 10.0 111.897 -171.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 50.6 m -19.58 -51.26 0.01 OUTLIER 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 128.189 2.596 . . . . 10.0 115.206 169.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 52.4 p-80 -144.68 53.1 1.24 Allowed 'General case' 0 CA--C 1.538 0.507 0 CA-C-O 120.999 0.428 . . . . 10.0 111.45 173.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -53.34 153.79 3.73 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.348 -0.845 . . . . 10.0 110.105 164.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 94.2 m -100.6 -35.56 9.46 Favored 'General case' 0 N--CA 1.47 0.526 0 O-C-N 121.203 -0.936 . . . . 10.0 111.001 169.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.09 -23.37 28.53 Favored 'General case' 0 N--CA 1.466 0.329 0 O-C-N 120.966 -1.084 . . . . 10.0 112.595 -171.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -81.71 -32.88 31.43 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 126.119 1.768 . . . . 10.0 109.768 178.764 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 43.6 m95 -85.08 -35.45 21.82 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.313 1.845 . . . . 10.0 111.459 178.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -42.64 -58.77 3.43 Favored Pre-proline 0 CA--C 1.549 0.909 0 N-CA-C 114.349 1.24 . . . . 10.0 114.349 174.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -73.27 15.58 0.5 Allowed 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 123.209 2.606 . . . . 10.0 113.743 -179.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -118.03 -49.71 2.5 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.81 1.644 . . . . 10.0 108.95 173.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 2.9 mt -54.65 -12.01 0.68 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.407 1.483 . . . . 10.0 114.38 170.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.91 -37.16 16.69 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 125.117 1.367 . . . . 10.0 110.019 -173.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 27.0 mtpt -77.98 -47.07 19.37 Favored 'General case' 0 N--CA 1.452 -0.337 0 N-CA-C 109.863 -0.421 . . . . 10.0 109.863 173.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 166.63 -126.2 1.43 Allowed Glycine 0 CA--C 1.528 0.903 0 N-CA-C 110.892 -0.883 . . . . 10.0 110.892 173.373 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 86.5 t -138.62 -64.57 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.209 0 C-N-CA 123.399 0.68 . . . . 10.0 110.96 -179.124 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.13 -35.7 59.99 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 119.065 -0.493 . . . . 10.0 111.373 -174.244 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -33.68 -42.22 0.11 Allowed 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.742 1.217 . . . . 10.0 112.566 171.124 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -81.37 -42.6 20.25 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.744 1.218 . . . . 10.0 112.524 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -53.52 -33.95 22.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 O-C-N 121.078 -1.014 . . . . 10.0 110.981 169.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.03 -44.31 96.98 Favored 'General case' 0 CA--C 1.545 0.761 0 O-C-N 121.394 -0.817 . . . . 10.0 112.622 169.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.6 m -61.47 -37.32 83.19 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 120.598 -1.314 . . . . 10.0 110.249 174.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 7.0 t -63.6 -55.1 24.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 122.866 0.466 . . . . 10.0 111.592 -178.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -56.03 -32.62 64.19 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.232 0.456 . . . . 10.0 112.232 176.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.3 m -72.23 -30.0 64.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.936 0.895 . . . . 10.0 112.077 179.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 74.97 94.64 0.14 Allowed Glycine 0 CA--C 1.53 0.983 0 CA-C-N 118.98 0.809 . . . . 10.0 111.903 -176.355 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 13.2 tp -65.0 170.5 4.32 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.93 -0.747 . . . . 10.0 111.696 177.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.478 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 5.5 m-80 -48.84 -58.19 5.21 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 120.612 -1.305 . . . . 10.0 112.946 -170.563 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -96.03 24.92 5.14 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.15 1.38 . . . . 10.0 112.768 173.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 35.3 ttp -132.01 127.19 21.0 Favored Pre-proline 0 CA--C 1.554 1.097 0 N-CA-C 114.5 1.296 . . . . 10.0 114.5 172.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.09 157.34 53.89 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 122.035 1.823 . . . . 10.0 112.937 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -64.78 129.92 24.74 Favored 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 123.663 2.908 . . . . 10.0 110.593 -175.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 72.02 25.46 74.67 Favored Glycine 0 CA--C 1.531 1.077 0 C-N-CA 121.575 -0.345 . . . . 10.0 112.429 -170.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 78.16 -46.3 2.7 Favored Glycine 0 CA--C 1.534 1.24 0 O-C-N 121.369 -1.077 . . . . 10.0 114.178 170.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -174.13 -48.27 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 127.387 2.275 . . . . 10.0 109.997 171.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 44.8 t -79.56 131.49 36.03 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.724 1.61 . . . . 10.0 110.9 177.374 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 99.5 m -89.54 -50.0 6.35 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 122.027 0.917 . . . . 10.0 110.212 173.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -78.88 60.6 2.9 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 127.725 2.41 . . . . 10.0 110.064 179.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 21.4 m -134.3 148.32 50.75 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 125.98 1.712 . . . . 10.0 110.615 174.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 59.4 m -108.93 155.78 20.45 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.639 1.576 . . . . 10.0 109.859 -178.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -46.17 -40.66 11.51 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.438 1.095 . . . . 10.0 112.99 177.326 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -57.12 -47.47 81.02 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.611 -0.68 . . . . 10.0 111.868 177.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.32 -44.07 63.22 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 108.812 -0.811 . . . . 10.0 108.812 -179.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -55.71 -49.95 71.63 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.266 0.555 . . . . 10.0 111.955 176.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.7 mtpt -67.75 -52.55 36.07 Favored 'General case' 0 C--O 1.218 -0.603 0 CA-C-O 118.071 -0.966 . . . . 10.0 108.777 -176.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.39 -39.3 15.01 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.736 1.153 . . . . 10.0 112.859 171.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.05 -50.26 50.11 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.387 -0.821 . . . . 10.0 110.825 -179.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 51.2 mt -58.31 -37.74 65.04 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.026 0 C-N-CA 125.498 1.519 . . . . 10.0 112.212 172.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -68.41 -38.22 81.05 Favored 'General case' 0 C--N 1.334 -0.098 0 C-N-CA 126.778 2.031 . . . . 10.0 111.596 175.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.8 t80 -52.03 -36.18 49.35 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.538 0.57 . . . . 10.0 112.538 172.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 66.1 mtm -80.45 -71.97 0.43 Allowed 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 123.777 0.831 . . . . 10.0 112.633 -179.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 7.0 t -162.96 45.59 0.13 Allowed 'General case' 0 N--CA 1.47 0.545 0 O-C-N 121.742 -0.599 . . . . 10.0 111.78 172.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.2 ptpt 36.11 57.98 0.99 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 126.048 1.739 . . . . 10.0 114.948 176.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.21 -80.01 0.04 OUTLIER 'General case' 0 C--O 1.223 -0.324 0 N-CA-C 112.425 0.528 . . . . 10.0 112.425 171.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.254 1.312 0 N-CA-C 116.005 1.854 . . . . 10.0 116.005 -169.083 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.868 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.386 0 N-CA-C 112.859 0.689 . . . . 10.0 112.859 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -161.25 98.66 1.16 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.569 1.548 . . . . 10.0 107.877 -179.576 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . 0.408 ' HA ' HD11 ' A' ' 6' ' ' ILE . 0.0 OUTLIER -145.9 31.45 1.04 Allowed 'General case' 0 C--O 1.223 -0.335 0 C-N-CA 124.361 1.064 . . . . 10.0 112.714 -176.372 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -97.72 -21.7 16.84 Favored 'General case' 0 CA--C 1.534 0.338 0 O-C-N 122.066 -0.396 . . . . 10.0 111.95 -171.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -143.85 125.22 14.72 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.775 1.23 . . . . 10.0 108.217 172.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -49.54 -39.24 33.84 Favored 'General case' 0 CA--C 1.537 0.481 0 C-N-CA 124.36 1.064 . . . . 10.0 112.558 170.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -59.97 -45.06 93.92 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 122.365 -0.209 . . . . 10.0 111.175 171.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.6 -34.25 76.63 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.366 -0.834 . . . . 10.0 110.667 -179.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.408 HD11 ' HA ' ' A' ' -1' ' ' LEU . 35.6 mt -64.37 -52.75 51.5 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.157 0 N-CA-C 108.432 -0.951 . . . . 10.0 108.432 178.07 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.45 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -69.65 -39.83 76.85 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 117.962 -1.495 . . . . 10.0 111.998 -178.147 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -68.46 -22.6 64.56 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.118 1.367 . . . . 10.0 112.45 -177.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.65 -28.73 15.82 Favored 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.444 0.905 . . . . 10.0 113.444 170.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.467 ' O ' HMC3 ' A' ' 90' ' ' HEC . . . -109.03 -67.7 0.96 Allowed 'General case' 0 N--CA 1.469 0.476 0 C-N-CA 123.854 0.862 . . . . 10.0 112.373 -171.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.45 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.78 45.07 0.4 Allowed 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 125.119 1.368 . . . . 10.0 110.159 -178.574 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.9 t -125.91 -15.13 5.98 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 120.495 -1.378 . . . . 10.0 113.859 -162.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.427 HG23 ' SG ' ' A' ' 14' ' ' CYS . 0.9 OUTLIER -95.02 -30.36 4.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 C-N-CA 124.596 1.158 . . . . 10.0 109.1 -175.328 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.427 ' SG ' HG23 ' A' ' 13' ' ' VAL . 96.1 m -107.4 -64.12 1.23 Allowed 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 128.254 2.622 . . . . 10.0 109.624 -173.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -74.8 -19.38 60.22 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.929 1.085 . . . . 10.0 113.929 -168.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 43.8 t -61.88 -50.67 71.27 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.502 0.721 . . . . 10.0 110.891 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 12.6 mmt -109.15 -13.96 14.58 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.311 1.444 . . . . 10.0 112.731 -175.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 80.91 45.6 7.59 Favored Glycine 0 CA--C 1.533 1.188 0 C-N-CA 124.43 1.014 . . . . 10.0 112.087 -175.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 91.9 t -90.52 159.88 2.79 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 124.855 1.262 . . . . 10.0 109.512 179.395 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.11 19.0 5.66 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.677 1.191 . . . . 10.0 113.754 -176.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 87.62 7.38 75.46 Favored Glycine 0 CA--C 1.537 1.443 0 C-N-CA 124.555 1.074 . . . . 10.0 113.804 -175.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.53 147.87 96.83 Favored Pre-proline 0 CA--C 1.543 0.682 0 CA-C-N 118.403 1.101 . . . . 10.0 113.234 -172.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -68.46 164.09 34.1 Favored 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 123.677 2.918 . . . . 10.0 110.351 174.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 74.0 mttt -84.76 142.68 29.64 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 121.523 -0.736 . . . . 10.0 111.919 -176.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -45.84 -28.06 1.0 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 125.449 1.5 . . . . 10.0 113.837 172.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -135.31 125.01 25.28 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.867 0.867 . . . . 10.0 109.282 164.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.1 m-20 -155.03 157.86 38.25 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 126.374 1.87 . . . . 10.0 106.496 172.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 75.7 m -108.39 -36.41 6.25 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.728 0.695 . . . . 10.0 111.464 171.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -77.28 -29.55 53.87 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.379 -0.825 . . . . 10.0 112.205 -177.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 16.0 t0 -75.98 -34.58 59.77 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.392 1.477 . . . . 10.0 110.177 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.459 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 58.9 m95 -84.7 -34.06 23.02 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 126.752 2.021 . . . . 10.0 112.024 179.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -39.01 -61.73 0.89 Allowed Pre-proline 0 CA--C 1.546 0.797 0 N-CA-C 114.719 1.377 . . . . 10.0 114.719 173.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -62.32 -16.62 52.49 Favored 'Trans proline' 0 CA--C 1.536 0.617 0 C-N-CA 122.766 2.311 . . . . 10.0 113.265 -177.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 15.4 mmt180 -87.5 -51.68 5.78 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.886 1.274 . . . . 10.0 109.269 -179.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.36 -17.53 30.72 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.509 1.524 . . . . 10.0 113.413 174.283 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -92.16 -38.6 12.05 Favored 'General case' 0 CA--C 1.527 0.083 0 C-N-CA 125.479 1.511 . . . . 10.0 109.97 -173.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.2 mmpt? -62.25 -51.67 66.79 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.145 -0.48 . . . . 10.0 109.806 167.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.409 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 160.7 -129.85 2.24 Favored Glycine 0 CA--C 1.533 1.174 0 N-CA-C 111.092 -0.803 . . . . 10.0 111.092 176.713 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 5.2 t -134.05 -58.03 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 123.848 0.859 . . . . 10.0 109.663 179.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -68.87 19.09 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 125.891 1.676 . . . . 10.0 114.63 -175.991 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.409 HD21 ' N ' ' A' ' 38' ' ' GLY . 1.2 m-20 -97.4 -26.22 14.94 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 127.591 2.356 . . . . 10.0 110.189 174.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -94.58 -47.48 6.51 Favored 'General case' 0 N--CA 1.445 -0.675 0 C-N-CA 123.694 0.797 . . . . 10.0 109.736 -175.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.512 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.6 OUTLIER -51.93 -32.92 15.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.657 1.183 . . . . 10.0 112.29 173.041 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 ptmt -71.38 -37.56 71.57 Favored 'General case' 0 CA--C 1.544 0.739 0 O-C-N 120.427 -1.42 . . . . 10.0 112.838 172.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.474 ' HA ' HG22 ' A' ' 48' ' ' THR . 2.6 t -75.87 -36.06 59.67 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.582 1.553 . . . . 10.0 110.996 -175.111 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.512 HG12 ' HA ' ' A' ' 43' ' ' VAL . 8.8 p -65.92 -48.27 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 O-C-N 121.408 -0.807 . . . . 10.0 110.852 168.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.41 -34.51 76.13 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.954 -0.698 . . . . 10.0 111.266 -176.049 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.474 HG22 ' HA ' ' A' ' 45' ' ' SER . 1.2 t -74.95 -32.61 61.78 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.798 -0.564 . . . . 10.0 112.018 174.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.5 112.1 1.0 Allowed Glycine 0 CA--C 1.532 1.144 0 C-N-CA 123.904 0.764 . . . . 10.0 112.684 -173.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.61 -175.51 4.39 Favored 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 123.68 0.792 . . . . 10.0 110.835 169.51 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -55.02 -64.44 0.83 Allowed 'General case' 0 N--CA 1.478 0.953 0 O-C-N 120.308 -1.495 . . . . 10.0 113.706 -162.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.429 ' HB3' HMD2 ' A' ' 90' ' ' HEC . . . -79.52 8.1 6.98 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 115.598 -0.728 . . . . 10.0 112.5 173.148 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.19 138.91 19.68 Favored Pre-proline 0 CA--C 1.54 0.566 0 N-CA-C 114.113 1.153 . . . . 10.0 114.113 -175.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -67.38 140.42 52.76 Favored 'Trans proline' 0 N--CA 1.454 -0.797 0 C-N-CA 122.094 1.862 . . . . 10.0 110.966 174.881 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -65.05 102.43 0.44 Allowed 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 123.458 2.772 . . . . 10.0 109.649 -179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 110.35 12.37 17.54 Favored Glycine 0 CA--C 1.53 1.024 0 C-N-CA 123.342 0.496 . . . . 10.0 113.435 -175.07 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 56.15 34.75 62.91 Favored Glycine 0 CA--C 1.531 1.092 0 CA-C-N 118.663 1.232 . . . . 10.0 111.876 -177.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 73.59 -7.08 1.64 Allowed 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 127.202 2.201 . . . . 10.0 114.074 -177.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.4 t -106.03 114.3 28.36 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.889 0.768 . . . . 10.0 112.113 -173.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 32.4 p -72.48 -53.4 12.22 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.321 1.048 . . . . 10.0 110.892 175.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.7 m-20 -101.31 77.18 1.77 Allowed 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.699 2.0 . . . . 10.0 109.024 177.428 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 12.0 m -123.87 132.63 53.79 Favored 'General case' 0 N--CA 1.466 0.365 0 O-C-N 121.572 -0.705 . . . . 10.0 110.844 161.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 10.8 p -79.25 163.27 25.09 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 122.159 -0.338 . . . . 10.0 110.198 171.053 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -55.98 -40.48 73.34 Favored 'General case' 0 CA--C 1.533 0.294 0 O-C-N 121.635 -0.666 . . . . 10.0 112.546 168.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -54.26 -51.83 63.31 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.728 0.695 . . . . 10.0 110.585 175.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 -72.62 -36.6 68.11 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 122.23 -0.294 . . . . 10.0 111.34 -177.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -61.32 -52.17 65.81 Favored 'General case' 0 CA--C 1.534 0.343 0 O-C-N 120.749 -1.219 . . . . 10.0 111.334 173.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 44.2 mttm -63.37 -46.88 84.47 Favored 'General case' 0 C--O 1.221 -0.42 0 C-N-CA 123.922 0.889 . . . . 10.0 109.823 -177.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.24 -40.86 49.01 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 121.323 0.582 . . . . 10.0 112.221 168.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -71.5 -39.82 70.57 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 120.865 -1.147 . . . . 10.0 112.051 -178.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.59 -55.49 19.58 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 124.078 0.951 . . . . 10.0 111.295 171.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -23.07 65.92 Favored 'General case' 0 CA--C 1.531 0.244 0 O-C-N 120.906 -1.121 . . . . 10.0 113.65 -177.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.6 t80 -43.69 -48.12 7.84 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.066 0.848 . . . . 10.0 111.364 168.087 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.459 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 3.6 mpp? -72.05 -50.02 31.86 Favored 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 112.228 0.455 . . . . 10.0 112.228 -179.249 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.84 -75.37 0.15 Allowed 'General case' 0 CA--C 1.535 0.374 0 CA-C-O 118.996 -0.526 . . . . 10.0 112.071 179.156 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 155.6 50.95 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 129.582 3.153 . . . . 10.0 111.589 -177.377 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -164.26 -82.37 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 114.344 1.239 . . . . 10.0 114.344 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.437 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.27 0 N-CA-C 114.855 1.428 . . . . 10.0 114.855 -176.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.866 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 117.233 -1.365 . . . . 10.0 108.407 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -161.88 109.0 1.37 Allowed 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.193 0.906 . . . . 10.0 110.375 178.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . 0.593 HD13 ' HA ' ' A' ' 62' ' ' CYS . 1.7 tp -115.45 86.33 2.44 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.236 1.815 . . . . 10.0 109.62 -178.307 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -113.32 -20.29 11.42 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 115.906 1.817 . . . . 10.0 115.906 177.009 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.444 ' O ' HD13 ' A' ' 6' ' ' ILE . 14.5 t70 -147.53 -160.4 1.16 Allowed 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.563 1.545 . . . . 10.0 107.664 -174.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -117.51 -40.2 3.08 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 128.609 2.764 . . . . 10.0 111.469 177.352 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.21 -46.85 82.53 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-O 121.239 0.542 . . . . 10.0 110.203 174.24 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.9 -29.33 69.19 Favored 'General case' 0 CA--C 1.532 0.257 0 O-C-N 121.72 -0.613 . . . . 10.0 110.91 -175.078 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.453 HD11 ' HA ' ' A' ' -1' ' ' LEU . 1.1 mp -67.92 -53.0 33.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.182 0 N-CA-C 108.236 -1.024 . . . . 10.0 108.236 177.628 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.434 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.6 OUTLIER -68.44 -40.52 81.11 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 117.309 -1.756 . . . . 10.0 111.359 -178.762 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -69.61 -22.62 63.48 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.62 1.568 . . . . 10.0 113.164 -177.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -96.38 -28.7 14.34 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 113.679 0.992 . . . . 10.0 113.679 170.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.47 -64.27 1.27 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.571 0.748 . . . . 10.0 112.011 -168.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.434 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.1 OUTLIER -73.92 29.13 0.08 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.591 1.157 . . . . 10.0 111.837 177.737 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -110.23 5.2 21.63 Favored 'General case' 0 CA--C 1.522 -0.124 0 O-C-N 120.583 -1.323 . . . . 10.0 113.984 -163.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 23.9 t -107.08 -44.4 7.27 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 125.048 1.339 . . . . 10.0 108.976 -172.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.7 m -95.85 -63.43 1.15 Allowed 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.92 2.088 . . . . 10.0 111.313 -177.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 35.9 m-70 -73.82 -23.26 59.63 Favored 'General case' 0 CA--C 1.537 0.444 0 N-CA-C 113.606 0.965 . . . . 10.0 113.606 -167.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 8.1 t -58.47 -45.97 87.58 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.566 1.146 . . . . 10.0 111.041 -178.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 25.9 mmt -111.78 -20.55 12.03 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 124.983 1.313 . . . . 10.0 112.68 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.87 48.32 3.67 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 123.823 0.725 . . . . 10.0 112.16 -176.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 74.4 t -92.94 161.54 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 C-N-CA 125.107 1.363 . . . . 10.0 109.26 177.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.64 20.04 5.97 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.589 1.156 . . . . 10.0 113.328 -174.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 71.95 26.37 72.72 Favored Glycine 0 CA--C 1.536 1.369 0 C-N-CA 124.219 0.914 . . . . 10.0 113.293 -173.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.69 144.19 76.48 Favored Pre-proline 0 CA--C 1.545 0.785 0 N-CA-C 113.926 1.084 . . . . 10.0 113.926 -176.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 68.4 Cg_endo -80.24 124.06 5.25 Favored 'Trans proline' 0 CA--C 1.537 0.646 1 C-N-CA 125.475 4.117 . . . . 10.0 111.759 -174.8 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -57.39 141.85 45.79 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 125.115 1.366 . . . . 10.0 112.485 -160.423 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 52.7 m -49.86 -56.94 8.52 Favored 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 112.532 0.568 . . . . 10.0 112.532 175.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -108.48 94.43 5.06 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 122.147 0.975 . . . . 10.0 111.098 178.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -135.72 166.5 23.13 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.226 1.41 . . . . 10.0 108.136 176.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 89.4 m -107.25 -38.59 5.93 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 118.259 0.482 . . . . 10.0 111.164 169.158 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.4 -16.15 47.02 Favored 'General case' 0 N--CA 1.465 0.311 0 O-C-N 120.868 -1.145 . . . . 10.0 113.22 -174.198 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -89.12 -23.49 22.47 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 126.199 1.8 . . . . 10.0 110.395 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 81.1 m95 -96.62 -36.0 10.87 Favored 'General case' 0 CA--C 1.551 1.017 0 C-N-CA 126.443 1.897 . . . . 10.0 111.631 176.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -42.16 -58.64 3.28 Favored Pre-proline 0 CA--C 1.549 0.915 0 N-CA-C 114.436 1.272 . . . . 10.0 114.436 172.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -75.14 15.54 0.75 Allowed 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 123.517 2.812 . . . . 10.0 113.397 -179.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.4 mmt85 -116.62 -45.42 2.8 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.555 1.542 . . . . 10.0 108.599 176.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.51 3.91 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 126.738 2.015 . . . . 10.0 114.916 165.803 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.02 -30.07 21.49 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 124.55 1.14 . . . . 10.0 110.289 177.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 4.7 mmpt? -88.66 -56.04 3.46 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 122.902 0.481 . . . . 10.0 110.056 174.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 160.63 -122.33 1.11 Allowed Glycine 0 CA--C 1.531 1.089 0 C-N-CA 124.492 1.044 . . . . 10.0 110.526 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -131.5 -58.48 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.348 0 C-N-CA 124.181 0.992 . . . . 10.0 110.929 179.174 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -75.73 35.54 0.13 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 125.604 1.562 . . . . 10.0 113.369 -170.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -113.04 -57.65 2.26 Favored 'General case' 0 C--N 1.332 -0.162 0 C-N-CA 128.017 2.527 . . . . 10.0 107.514 179.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mt -67.23 -29.5 69.16 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.916 1.286 . . . . 10.0 110.263 -175.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.2 p -55.69 -17.61 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.492 0 C-N-CA 126.04 1.736 . . . . 10.0 113.743 168.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 18.9 mtmt -93.23 -43.38 8.85 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 112.976 0.732 . . . . 10.0 112.976 172.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.457 ' HA ' HG22 ' A' ' 48' ' ' THR . 4.4 m -61.8 -32.3 72.58 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 122.121 0.962 . . . . 10.0 109.749 177.068 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 5.5 p -69.9 -38.52 75.82 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 112.931 0.715 . . . . 10.0 112.931 170.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.4 -32.77 68.8 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.344 -0.848 . . . . 10.0 112.443 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.457 HG22 ' HA ' ' A' ' 45' ' ' SER . 10.1 t -75.47 -36.64 60.61 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.819 0.848 . . . . 10.0 113.211 173.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 82.77 117.66 0.56 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 111.607 -0.597 . . . . 10.0 111.607 -167.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.29 -150.87 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.268 0.627 . . . . 10.0 110.062 164.178 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -75.95 -67.23 0.7 Allowed 'General case' 0 N--CA 1.476 0.834 0 O-C-N 119.482 -2.011 . . . . 10.0 112.156 -172.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -79.68 -12.35 59.82 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.899 1.279 . . . . 10.0 111.919 174.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.1 mmm -78.24 129.31 75.62 Favored Pre-proline 0 CA--C 1.536 0.437 0 C-N-CA 123.151 0.58 . . . . 10.0 111.497 172.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -69.28 145.45 59.99 Favored 'Trans proline' 0 N--CA 1.452 -0.939 0 C-N-CA 121.685 1.59 . . . . 10.0 110.071 176.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -61.59 130.06 30.2 Favored 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 122.656 2.237 . . . . 10.0 109.736 177.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 74.76 26.7 66.57 Favored Glycine 0 CA--C 1.528 0.875 0 C-N-CA 119.397 -1.382 . . . . 10.0 112.051 -178.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 40.91 34.99 0.86 Allowed Glycine 0 CA--C 1.534 1.264 0 C-N-CA 126.123 1.821 . . . . 10.0 115.903 177.556 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 60.72 38.21 18.46 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.758 1.223 . . . . 10.0 112.868 -175.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -126.84 147.91 50.01 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 126.702 2.001 . . . . 10.0 109.666 179.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 85.7 m -116.15 -77.93 0.57 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.341 0.657 . . . . 10.0 110.245 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -79.1 46.3 0.69 Allowed 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.55 1.14 . . . . 10.0 111.055 -173.276 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.593 ' HA ' HD13 ' A' ' -1' ' ' LEU . 4.5 m -125.52 138.69 53.98 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 126.171 1.788 . . . . 10.0 110.918 -166.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 45.8 m -112.17 -103.33 0.4 Allowed 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 118.979 0.809 . . . . 10.0 109.948 -171.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -139.74 -48.42 0.46 Allowed 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 124.568 1.147 . . . . 10.0 109.011 -178.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -43.84 -60.27 1.89 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 120.325 1.421 . . . . 10.0 113.854 175.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.549 ' HB2' HD11 ' A' ' -1' ' ' LEU . 50.2 m-20 -74.32 -29.93 61.83 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.596 0.712 . . . . 10.0 110.217 -178.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -44.85 95.67 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 121.226 -0.921 . . . . 10.0 113.058 177.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 1.5 mptm? -62.35 -56.34 19.28 Favored 'General case' 0 C--O 1.224 -0.241 0 C-N-CA 124.547 1.139 . . . . 10.0 108.373 174.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -51.42 -33.34 30.07 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 112.626 0.602 . . . . 10.0 112.626 178.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -65.76 -47.25 75.86 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.242 -0.911 . . . . 10.0 111.829 175.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -57.01 -47.83 82.81 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 C-N-CA 123.702 0.801 . . . . 10.0 111.119 170.048 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -64.38 -36.39 83.98 Favored 'General case' 0 C--O 1.228 -0.074 0 O-C-N 121.243 -0.911 . . . . 10.0 113.192 179.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -49.57 -49.69 45.36 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 118.728 0.695 . . . . 10.0 111.088 176.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 75.8 mtm -66.45 -45.16 80.74 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 122.996 0.518 . . . . 10.0 112.39 -179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -157.56 -71.79 0.09 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 118.774 -0.632 . . . . 10.0 112.566 172.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 13.4 ptpt 152.21 57.87 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 130.073 3.349 . . . . 10.0 112.106 -178.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -170.56 -75.52 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.586 0 N-CA-C 114.505 1.298 . . . . 10.0 114.505 170.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 5.3 pttp . . . . . 0 C--O 1.254 1.303 0 C-N-CA 125.666 1.586 . . . . 10.0 114.626 -172.571 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.859 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.125 0 CA-C-O 117.408 -1.282 . . . . 10.0 109.187 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 52.1 t0 -162.82 127.51 3.11 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.679 0.792 . . . . 10.0 110.39 179.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -111.92 72.75 0.79 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 126.762 2.025 . . . . 10.0 108.767 -179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 17.9 mt-30 -102.96 -25.38 13.48 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 124.838 1.255 . . . . 10.0 112.31 172.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -149.43 112.93 5.0 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 123.64 0.776 . . . . 10.0 110.027 178.822 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -32.17 -46.65 0.13 Allowed 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.816 2.046 . . . . 10.0 115.158 162.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 51.0 tt0 -58.66 -48.58 80.58 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-N 118.833 0.742 . . . . 10.0 110.724 173.214 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.46 -33.98 76.23 Favored 'General case' 0 C--O 1.226 -0.159 0 O-C-N 121.893 -0.504 . . . . 10.0 110.327 -177.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 2.7 mm -65.83 -51.0 66.68 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.235 0 CA-C-O 118.459 -0.781 . . . . 10.0 109.212 176.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.482 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -67.8 -40.41 83.89 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 117.686 -1.605 . . . . 10.0 111.445 -179.656 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -68.88 -23.38 64.2 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 125.389 1.476 . . . . 10.0 112.957 -178.745 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.7 -27.85 15.63 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 124.985 1.314 . . . . 10.0 112.831 171.802 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.475 ' O ' HMC3 ' A' ' 90' ' ' HEC . . . -112.71 -65.81 1.15 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.76 1.224 . . . . 10.0 113.456 -172.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.482 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.94 45.58 0.35 Allowed 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 124.159 0.984 . . . . 10.0 110.148 179.731 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.0 t -129.22 -15.14 4.21 Favored 'General case' 0 N--CA 1.466 0.337 0 O-C-N 120.459 -1.401 . . . . 10.0 113.856 -162.502 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 19.6 m -97.59 -42.83 11.88 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.361 0 C-N-CA 124.185 0.994 . . . . 10.0 109.552 -177.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 16.7 m -85.8 -64.34 1.17 Allowed 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 126.831 2.052 . . . . 10.0 110.262 177.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -73.49 -26.1 60.74 Favored 'General case' 0 CA--C 1.537 0.478 0 N-CA-C 113.637 0.977 . . . . 10.0 113.637 -165.159 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.0 t -56.06 -49.27 74.24 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.896 0.878 . . . . 10.0 111.136 -178.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.0 mmt -112.88 -9.21 13.66 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.726 0.81 . . . . 10.0 112.445 -178.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.61 42.88 8.12 Favored Glycine 0 CA--C 1.533 1.197 0 O-C-N 121.575 -0.703 . . . . 10.0 111.896 -179.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 50.1 t -88.89 161.27 2.73 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 125.081 1.352 . . . . 10.0 109.12 179.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.7 18.16 4.59 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.42 1.088 . . . . 10.0 113.933 -175.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 84.54 11.55 77.35 Favored Glycine 0 CA--C 1.535 1.29 0 C-N-CA 124.69 1.138 . . . . 10.0 113.787 -176.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.08 152.09 94.78 Favored Pre-proline 0 CA--C 1.538 0.512 0 CA-C-N 118.702 1.251 . . . . 10.0 113.757 -174.148 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 76.3 Cg_endo -76.75 138.42 18.92 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 123.12 2.546 . . . . 10.0 110.83 -176.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.62 127.38 22.73 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 124.226 1.01 . . . . 10.0 113.008 -173.356 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 91.0 p 0.84 -82.39 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.447 0 C-N-CA 128.15 2.58 . . . . 10.0 115.349 171.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 2.6 p80 -144.66 110.95 5.55 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 122.073 0.939 . . . . 10.0 110.051 170.636 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -128.45 -178.37 4.54 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.589 1.556 . . . . 10.0 110.235 174.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.9 t -99.35 -32.79 10.99 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 118.333 0.515 . . . . 10.0 112.11 169.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.42 -53.48 57.07 Favored 'General case' 0 CA--C 1.536 0.415 0 O-C-N 120.585 -1.322 . . . . 10.0 114.306 -171.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -79.74 -21.86 43.98 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-O 121.622 0.725 . . . . 10.0 110.837 -178.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.442 ' HE3' ' HB3' ' A' ' 77' ' ' ALA . 71.9 m95 -79.64 -29.28 40.95 Favored 'General case' 0 CA--C 1.554 1.114 0 O-C-N 121.348 -0.845 . . . . 10.0 112.259 174.511 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -47.12 -61.41 2.85 Favored Pre-proline 0 CA--C 1.542 0.669 0 C-N-CA 125.641 1.576 . . . . 10.0 114.955 -179.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -62.91 -16.39 53.61 Favored 'Trans proline' 0 CA--C 1.537 0.659 0 C-N-CA 122.186 1.924 . . . . 10.0 112.914 179.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.6 mmt85 -82.92 -46.43 12.97 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.766 1.226 . . . . 10.0 108.34 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.606 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -63.11 -17.9 62.83 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.381 1.872 . . . . 10.0 112.518 172.888 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.18 -33.15 26.26 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.452 1.101 . . . . 10.0 109.666 177.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 54.6 mtmt -74.84 -51.62 13.5 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 122.236 0.215 . . . . 10.0 111.075 171.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.426 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 156.21 -104.52 0.25 Allowed Glycine 0 CA--C 1.531 1.082 0 C-N-CA 123.088 0.375 . . . . 10.0 112.626 170.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -147.54 -61.62 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.377 0 C-N-CA 123.98 0.912 . . . . 10.0 110.439 175.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.408 ' HA ' HG12 ' A' ' 43' ' ' VAL . 0.9 OUTLIER -76.71 36.44 0.16 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.333 1.453 . . . . 10.0 113.096 -170.94 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.426 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -111.99 -54.1 2.64 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.786 -1.931 . . . . 10.0 105.786 -176.632 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -79.56 -33.71 41.58 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.201 1.0 . . . . 10.0 111.618 -177.592 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.408 HG12 ' HA ' ' A' ' 40' ' ' ASP . 0.5 OUTLIER -64.02 -11.21 9.14 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 121.65 -0.656 . . . . 10.0 111.8 170.756 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.6 mmpt? -78.78 -45.3 21.3 Favored 'General case' 0 CA--C 1.547 0.829 0 O-C-N 121.017 -1.052 . . . . 10.0 111.383 163.186 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 33.9 m -63.9 -38.27 90.45 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 120.294 -1.504 . . . . 10.0 110.766 -179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -56.57 -39.45 62.51 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 CA-C-O 121.424 0.631 . . . . 10.0 111.968 177.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HA ' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -77.39 -29.66 53.25 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.003 0.521 . . . . 10.0 111.776 -179.811 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 99.2 m -73.11 -32.12 64.74 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.447 0.699 . . . . 10.0 112.623 175.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.12 111.54 0.92 Allowed Glycine 0 C--N 1.34 0.778 0 N-CA-C 110.327 -1.109 . . . . 10.0 110.327 -170.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.44 -163.18 0.09 Allowed 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 124.685 1.194 . . . . 10.0 109.278 162.571 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -74.12 -67.42 0.61 Allowed 'General case' 0 N--CA 1.476 0.826 0 O-C-N 119.888 -1.758 . . . . 10.0 112.492 -170.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -65.38 -33.9 77.04 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.217 1.007 . . . . 10.0 111.166 173.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -73.03 128.96 87.07 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 126.4 1.88 . . . . 10.0 112.086 -172.166 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -67.16 144.23 68.18 Favored 'Trans proline' 0 N--CA 1.453 -0.896 0 C-N-CA 121.632 1.555 . . . . 10.0 110.135 177.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_endo -61.27 126.38 19.23 Favored 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 122.551 2.167 . . . . 10.0 109.439 175.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.436 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 93.06 25.53 19.31 Favored Glycine 0 CA--C 1.528 0.896 0 C-N-CA 120.987 -0.625 . . . . 10.0 112.939 179.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.83 35.11 4.23 Favored Glycine 0 CA--C 1.543 1.837 0 CA-C-N 118.002 0.901 . . . . 10.0 114.507 -177.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 14.3 ttm 70.13 -4.04 1.64 Allowed 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 127.247 2.219 . . . . 10.0 114.926 -176.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -104.51 -38.88 6.61 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 121.064 -1.023 . . . . 10.0 112.511 -179.096 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 72.9 m 67.38 -60.65 0.37 Allowed 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 126.517 1.927 . . . . 10.0 112.86 -176.36 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -79.64 57.05 2.37 Favored 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 124.724 1.21 . . . . 10.0 110.351 -177.296 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.7 m -112.15 123.0 49.31 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.154 1.382 . . . . 10.0 110.655 -171.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.4 t -93.57 133.31 37.01 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.342 -0.614 . . . . 10.0 109.342 173.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -32.37 -41.73 0.06 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 126.893 2.077 . . . . 10.0 113.326 171.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -40.61 -61.29 0.96 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.692 1.197 . . . . 10.0 113.7 170.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -86.12 -28.3 24.09 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 118.674 0.67 . . . . 10.0 111.383 178.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -43.7 78.31 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.948 -1.095 . . . . 10.0 111.244 176.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 5.7 ptmm? -72.49 -45.16 60.77 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.513 1.125 . . . . 10.0 109.698 178.076 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.504 ' HA ' ' HG2' ' A' ' 72' ' ' GLU . . . -50.25 -38.03 38.72 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 121.798 0.809 . . . . 10.0 111.889 173.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.29 -41.78 76.34 Favored 'General case' 0 N--CA 1.463 0.202 0 C-N-CA 123.912 0.885 . . . . 10.0 111.851 -176.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 27.3 pt -76.24 -42.28 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.76 0 O-C-N 121.751 -0.593 . . . . 10.0 111.761 175.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . 0.504 ' HG2' ' HA ' ' A' ' 69' ' ' ALA 0.258 5.7 pt-20 -64.67 -25.09 67.8 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.659 -0.651 . . . . 10.0 111.905 177.827 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -49.33 -44.43 44.48 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 118.587 0.63 . . . . 10.0 112.112 164.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 70.0 mtm -82.0 -57.26 3.49 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.464 0.705 . . . . 10.0 110.332 178.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 27.1 t -177.65 121.21 0.11 Allowed 'General case' 0 C--O 1.223 -0.31 0 C-N-CA 126.822 2.049 . . . . 10.0 108.207 176.391 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.57 83.1 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.689 0 O-C-N 121.001 -1.062 . . . . 10.0 112.984 178.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.606 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -157.76 -69.58 0.09 Allowed 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 114.055 1.131 . . . . 10.0 114.055 -178.167 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.701 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 4.7 ptpp? . . . . . 0 C--O 1.249 1.072 0 C-N-CA 124.198 0.999 . . . . 10.0 112.103 -177.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.701 HMA3 ' HB2' ' A' ' 78' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.074 0 CA-C-O 117.205 -1.378 . . . . 10.0 109.409 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -162.56 134.38 5.31 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-N 119.387 0.994 . . . . 10.0 111.012 -170.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . 0.446 HD22 ' O ' ' A' ' -1' ' ' LEU . 0.0 OUTLIER -73.83 51.72 0.39 Allowed 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 124.848 1.259 . . . . 10.0 112.701 -174.449 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.39 -18.55 18.23 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.15 0.98 . . . . 10.0 113.134 -166.242 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -138.18 -172.46 3.28 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 127.35 2.26 . . . . 10.0 106.399 179.213 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.434 ' HB1' ' HA ' ' A' ' 70' ' ' ALA . . . -89.56 -45.65 9.23 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 127.653 2.381 . . . . 10.0 111.562 174.551 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.4 tt0 -55.02 -50.09 69.9 Favored 'General case' 0 C--N 1.341 0.228 0 CA-C-O 121.931 0.872 . . . . 10.0 110.43 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.82 -31.44 69.33 Favored 'General case' 0 N--CA 1.453 -0.308 0 CA-C-N 115.55 -0.75 . . . . 10.0 111.464 -177.61 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -66.72 -52.06 49.45 Favored 'Isoleucine or valine' 0 C--N 1.34 0.18 0 N-CA-C 108.273 -1.01 . . . . 10.0 108.273 176.081 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -69.51 -41.49 75.99 Favored 'General case' 0 CA--C 1.53 0.176 0 CA-C-N 119.461 1.028 . . . . 10.0 110.328 -174.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -69.14 -23.97 64.03 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 124.464 1.106 . . . . 10.0 112.254 -178.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 16.7 ttpp -86.16 -30.48 22.45 Favored 'General case' 0 CA--C 1.543 0.682 0 O-C-N 121.18 -0.95 . . . . 10.0 113.423 166.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.38 -69.5 0.86 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 124.226 1.011 . . . . 10.0 112.84 -164.419 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -74.39 31.9 0.09 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.876 1.67 . . . . 10.0 111.234 179.861 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 14.9 t -111.38 8.71 21.38 Favored 'General case' 0 N--CA 1.462 0.134 0 C-N-CA 124.624 1.17 . . . . 10.0 113.268 -164.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 3.7 t -111.42 -45.88 5.81 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 124.772 1.229 . . . . 10.0 108.902 -173.035 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.7 m -92.44 -64.24 1.13 Allowed 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.946 1.699 . . . . 10.0 111.423 176.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 15.4 m-70 -73.08 -25.65 60.97 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.425 0.69 . . . . 10.0 112.426 -166.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -55.03 -53.43 55.93 Favored 'General case' 0 N--CA 1.466 0.325 0 C-N-CA 124.648 1.179 . . . . 10.0 111.014 -179.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.6 ttt -105.43 -21.03 13.31 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.283 1.033 . . . . 10.0 112.047 -178.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.95 53.48 2.37 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 124.111 0.862 . . . . 10.0 112.095 -175.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 22.8 t -95.05 162.66 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 C-N-CA 125.131 1.372 . . . . 10.0 109.299 177.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 60.01 16.37 5.8 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.657 1.183 . . . . 10.0 113.976 -177.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.5 22.12 79.13 Favored Glycine 0 CA--C 1.536 1.36 0 C-N-CA 123.524 0.583 . . . . 10.0 113.028 -171.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.95 157.07 77.84 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 124.104 0.962 . . . . 10.0 112.07 177.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -72.79 165.27 33.23 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 122.577 2.185 . . . . 10.0 110.606 -178.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 1.9 tptt -77.37 126.42 30.88 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 115.881 -0.6 . . . . 10.0 111.652 -175.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.7 t -34.02 -42.69 0.13 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 127.391 2.276 . . . . 10.0 114.573 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.0 p-80 -138.59 133.51 32.6 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 108.459 -0.941 . . . . 10.0 108.459 157.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -148.59 168.43 22.79 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 125.565 1.546 . . . . 10.0 108.75 170.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.3 t -104.75 -36.83 7.29 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 120.567 -0.453 . . . . 10.0 111.438 164.459 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.57 -23.47 42.73 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 119.959 -1.713 . . . . 10.0 114.025 -174.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 25.6 t0 -82.68 -34.58 27.32 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.092 1.357 . . . . 10.0 109.33 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.45 ' CH2' ' CB ' ' A' ' 74' ' ' MET . 45.9 m95 -85.82 -34.44 21.08 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 125.899 1.68 . . . . 10.0 111.907 179.755 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -43.63 -57.27 5.91 Favored Pre-proline 0 CA--C 1.543 0.69 0 C-N-CA 125.227 1.411 . . . . 10.0 114.43 174.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -65.25 -5.67 11.63 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 122.648 2.232 . . . . 10.0 113.898 -179.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.442 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 8.8 mmt180 -103.05 -46.99 4.48 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.863 1.265 . . . . 10.0 110.369 179.038 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 7.2 mt -55.06 -4.3 0.07 Allowed 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.883 1.673 . . . . 10.0 114.405 166.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -88.67 -33.31 17.62 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.087 1.355 . . . . 10.0 110.193 -176.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.53 -54.36 6.23 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.665 -0.494 . . . . 10.0 109.665 171.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.471 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 166.58 -132.89 2.75 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 110.916 -0.874 . . . . 10.0 110.916 -177.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 62.5 t -140.39 -56.92 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 C-N-CA 124.181 0.992 . . . . 10.0 110.476 -173.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.42 ' HA ' HG12 ' A' ' 43' ' ' VAL . 62.2 m-20 -69.88 11.19 0.31 Allowed 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 113.701 1.0 . . . . 10.0 113.701 -176.695 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.471 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -92.68 -21.67 19.87 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 127.516 2.327 . . . . 10.0 111.143 -179.69 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.667 ' HB3' HMA2 ' A' ' 90' ' ' HEC . 0.6 OUTLIER -106.4 -32.16 8.25 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.522 0.729 . . . . 10.0 110.874 -177.912 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.42 HG12 ' HA ' ' A' ' 40' ' ' ASP . 1.8 p -60.31 -23.79 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.35 0 C-N-CA 125.68 1.592 . . . . 10.0 111.281 169.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.53 -44.66 57.08 Favored 'General case' 0 CA--C 1.545 0.768 0 O-C-N 121.363 -0.835 . . . . 10.0 111.875 167.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.598 ' HA ' HG22 ' A' ' 48' ' ' THR . 0.4 OUTLIER -76.05 -23.87 55.12 Favored 'General case' 0 N--CA 1.468 0.429 0 O-C-N 120.989 -1.069 . . . . 10.0 111.901 -174.319 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.426 HG13 ' CZ ' ' A' ' 67' ' ' TYR . 1.7 p -68.95 -40.64 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 O-C-N 121.027 -1.045 . . . . 10.0 111.129 172.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -71.64 -31.0 66.38 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 121.149 0.5 . . . . 10.0 111.372 -178.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . 0.598 HG22 ' HA ' ' A' ' 45' ' ' SER . 1.5 t -89.43 -22.39 22.54 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.0 1.32 . . . . 10.0 112.495 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.05 117.56 0.82 Allowed Glycine 0 CA--C 1.535 1.307 0 N-CA-C 111.355 -0.698 . . . . 10.0 111.355 -170.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.1 tp -74.42 -152.48 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.992 0 O-C-N 122.031 -0.687 . . . . 10.0 110.393 169.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -65.27 -63.9 0.99 Allowed 'General case' 0 N--CA 1.471 0.618 0 O-C-N 119.753 -1.842 . . . . 10.0 111.592 -175.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -101.39 44.19 1.02 Allowed 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 113.282 -1.781 . . . . 10.0 109.084 -175.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -143.12 134.76 12.91 Favored Pre-proline 0 CA--C 1.536 0.42 0 C-N-CA 124.58 1.152 . . . . 10.0 111.606 -177.623 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -74.42 156.41 45.65 Favored 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 121.866 1.711 . . . . 10.0 110.211 176.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -66.67 120.52 7.64 Favored 'Trans proline' 0 N--CA 1.453 -0.892 0 C-N-CA 122.759 2.306 . . . . 10.0 110.165 179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.6 34.97 6.35 Favored Glycine 0 CA--C 1.531 1.087 0 O-C-N 122.091 -0.381 . . . . 10.0 113.242 -179.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.415 ' HA3' HBB2 ' A' ' 90' ' ' HEC . . . 57.18 -84.27 0.01 OUTLIER Glycine 0 CA--C 1.534 1.262 0 C-N-CA 124.556 1.074 . . . . 10.0 114.345 172.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -175.0 38.93 0.01 OUTLIER 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 126.986 2.114 . . . . 10.0 112.376 165.322 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -125.45 147.77 49.08 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.751 1.221 . . . . 10.0 111.153 -175.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 10.8 t -71.42 -50.13 34.93 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 112.082 0.401 . . . . 10.0 112.082 -173.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 63.5 t0 -123.81 76.13 1.41 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.229 1.412 . . . . 10.0 108.473 175.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 8.3 m -71.87 91.1 1.15 Allowed 'General case' 0 CA--C 1.538 0.5 0 O-C-N 120.889 -1.132 . . . . 10.0 111.19 -179.695 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.3 p -78.51 149.39 33.14 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 121.151 -0.968 . . . . 10.0 108.495 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -58.79 -37.32 76.07 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 120.315 1.416 . . . . 10.0 112.084 172.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 25.2 pt-20 -51.49 -46.6 63.22 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 119.065 -0.493 . . . . 10.0 111.608 174.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 34.0 m-20 -82.85 -39.43 21.64 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 118.829 0.74 . . . . 10.0 112.624 176.584 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . 0.426 ' CZ ' HG13 ' A' ' 46' ' ' VAL . 0.1 OUTLIER -55.99 -46.22 78.78 Favored 'General case' 0 N--CA 1.463 0.22 0 O-C-N 120.5 -1.375 . . . . 10.0 111.543 -178.226 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 7.2 mtpm? -68.5 -45.79 71.39 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 108.939 -0.763 . . . . 10.0 108.939 -177.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.66 -38.97 61.37 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 121.633 0.73 . . . . 10.0 112.647 169.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.434 ' HA ' ' HB1' ' A' ' 3' ' ' ALA . . . -80.05 -39.55 29.56 Favored 'General case' 0 C--O 1.225 -0.226 0 O-C-N 120.602 -1.311 . . . . 10.0 113.592 -174.804 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 13.0 mt -70.38 -38.18 73.22 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 O-C-N 121.831 -0.543 . . . . 10.0 110.466 171.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . 0.299 0.0 OUTLIER -69.59 -31.71 70.02 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 114.195 1.183 . . . . 10.0 114.195 176.629 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 37.2 t80 -42.02 -47.14 4.38 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 124.628 1.171 . . . . 10.0 112.17 173.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.45 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.2 mpp? -81.65 -73.14 0.4 Allowed 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 112.505 0.558 . . . . 10.0 112.505 -179.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -160.2 33.87 0.17 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.155 0.582 . . . . 10.0 112.063 178.59 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.269 16.0 ptpt 42.62 46.81 4.4 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.892 1.677 . . . . 10.0 114.137 -179.297 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.496 ' O ' HMA3 ' A' ' 90' ' ' HEC . . . -150.97 -92.71 0.06 Allowed 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 114.965 1.469 . . . . 10.0 114.965 -178.864 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.4 ' HB2' ' CAA' ' A' ' 90' ' ' HEC . 7.4 pttt . . . . . 0 C--O 1.253 1.25 0 N-CA-C 116.071 1.878 . . . . 10.0 116.071 -175.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.713 HMC1 ' CBC' ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.335 0 N-CA-C 112.75 0.648 . . . . 10.0 112.75 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 46.5 t0 -167.4 128.39 1.51 Allowed 'General case' 0 CA--C 1.539 0.519 0 C-N-CA 123.212 0.605 . . . . 10.0 109.943 -171.38 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . 0.402 ' HA ' HD11 ' A' ' 6' ' ' ILE . 2.6 tp -76.78 67.96 2.93 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.434 0.561 . . . . 10.0 110.831 177.659 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -111.52 -19.69 12.46 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.817 1.043 . . . . 10.0 113.817 179.369 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -139.69 -137.44 0.12 Allowed 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 124.365 1.066 . . . . 10.0 110.366 -172.162 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -147.94 -49.45 0.17 Allowed 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 130.344 3.457 . . . . 10.0 109.302 -174.61 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -54.26 -50.51 67.07 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 121.247 0.546 . . . . 10.0 110.301 171.103 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 -29.75 68.69 Favored 'General case' 0 CA--C 1.53 0.194 0 O-C-N 121.777 -0.577 . . . . 10.0 111.415 -176.363 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.402 HD11 ' HA ' ' A' ' -1' ' ' LEU . 1.5 mp -68.8 -52.67 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 N-CA-C 107.932 -1.136 . . . . 10.0 107.932 178.004 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.425 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -68.23 -41.25 81.53 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 118.225 -1.39 . . . . 10.0 110.918 -179.612 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -68.51 -22.95 64.5 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.132 1.373 . . . . 10.0 112.546 -176.779 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.72 -29.74 16.66 Favored 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 114.37 1.248 . . . . 10.0 114.37 166.298 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.27 -66.19 1.09 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 119.104 0.865 . . . . 10.0 112.363 -167.121 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.425 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.2 42.84 0.27 Allowed 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 124.126 0.971 . . . . 10.0 109.883 177.604 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 9.7 t -122.56 -6.88 8.64 Favored 'General case' 0 N--CA 1.465 0.281 0 O-C-N 120.477 -1.389 . . . . 10.0 114.03 -164.056 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 33.8 m -105.88 -41.97 6.51 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.254 0 C-N-CA 123.59 0.756 . . . . 10.0 109.352 -178.219 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 36.3 m -86.88 -63.91 1.23 Allowed 'General case' 0 N--CA 1.447 -0.605 0 C-N-CA 125.657 1.583 . . . . 10.0 110.136 177.992 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -74.1 -28.23 61.26 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 114.277 1.214 . . . . 10.0 114.277 -167.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.1 t -59.58 -51.36 70.15 Favored 'General case' 0 N--CA 1.467 0.406 0 C-N-CA 123.565 0.746 . . . . 10.0 111.408 -179.049 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 28.9 mmt -101.76 -19.49 15.33 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.434 0.694 . . . . 10.0 111.844 -179.531 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.18 49.59 4.17 Favored Glycine 0 CA--C 1.532 1.143 0 O-C-N 121.428 -0.795 . . . . 10.0 111.986 -178.222 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 66.6 t -99.29 162.95 2.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 126.127 1.771 . . . . 10.0 109.313 -177.816 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.68 19.66 8.34 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.411 1.084 . . . . 10.0 113.367 -176.237 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 81.23 10.29 84.94 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 124.522 1.058 . . . . 10.0 113.142 -174.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.96 144.49 95.77 Favored Pre-proline 0 CA--C 1.541 0.606 0 CA-C-N 118.422 1.111 . . . . 10.0 112.767 -176.863 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.446 ' CG ' ' HE3' ' A' ' 78' ' ' LYS . 42.6 Cg_endo -81.14 151.77 18.25 Favored 'Trans proline' 0 N--CA 1.451 -0.975 0 C-N-CA 124.784 3.656 . . . . 10.0 110.392 179.349 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.2 mptt -103.25 143.2 32.96 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 116.123 -0.49 . . . . 10.0 111.211 -166.308 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.3 p -77.05 55.23 1.11 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.207 1.003 . . . . 10.0 112.46 175.131 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -146.96 -45.59 0.18 Allowed 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 114.072 1.138 . . . . 10.0 114.072 175.939 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -71.25 149.2 46.45 Favored 'General case' 0 C--O 1.226 -0.145 0 N-CA-C 108.369 -0.974 . . . . 10.0 108.369 -177.925 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 9.5 t -95.46 -30.5 13.83 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 118.652 0.66 . . . . 10.0 110.139 178.111 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.42 -29.08 69.72 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 114.65 1.352 . . . . 10.0 114.65 -178.234 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -76.42 -31.39 57.88 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-O 122.34 1.067 . . . . 10.0 111.075 176.832 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 73.4 m95 -89.47 -32.02 17.41 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.32 1.448 . . . . 10.0 112.355 -177.038 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -49.18 -57.45 11.57 Favored Pre-proline 0 CA--C 1.542 0.667 0 O-C-N 120.461 -1.4 . . . . 10.0 114.609 175.509 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -65.72 -1.33 4.8 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 122.609 2.206 . . . . 10.0 113.209 178.617 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 9.5 mmt85 -101.14 -55.16 2.62 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.987 1.315 . . . . 10.0 108.513 176.806 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.519 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 1.0 OUTLIER -60.07 -13.73 13.15 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.725 1.61 . . . . 10.0 114.472 175.827 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -86.11 -38.84 17.34 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 124.363 1.065 . . . . 10.0 109.422 -174.135 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -75.49 -45.56 37.63 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.549 -0.75 . . . . 10.0 110.932 174.594 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 161.92 -136.32 4.32 Favored Glycine 0 CA--C 1.533 1.158 0 N-CA-C 110.822 -0.911 . . . . 10.0 110.822 -178.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 67.0 t -139.61 -57.53 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 122.524 1.154 . . . . 10.0 111.048 179.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -43.33 -36.78 1.99 Allowed 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 126.281 1.832 . . . . 10.0 112.988 170.949 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -47.21 -27.32 1.45 Allowed 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 113.822 1.045 . . . . 10.0 113.822 173.883 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.468 ' HB3' ' CMA' ' A' ' 90' ' ' HEC . 1.1 mm? -100.45 -38.48 8.39 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 125.206 1.402 . . . . 10.0 111.471 179.535 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -53.26 -36.81 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 CA-C-N 118.912 0.778 . . . . 10.0 110.285 170.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.9 ptmt -63.72 -44.24 94.17 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 114.145 1.165 . . . . 10.0 114.145 171.446 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.7 m -64.46 -33.96 77.1 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 120.91 -1.119 . . . . 10.0 110.241 178.669 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 17.6 t -62.42 -55.0 26.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 123.736 0.814 . . . . 10.0 112.072 176.328 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -54.82 -36.97 65.56 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-O 120.762 0.315 . . . . 10.0 111.617 177.28 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 21.7 m -71.13 -34.67 71.26 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 123.945 0.898 . . . . 10.0 111.79 -177.802 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 75.4 112.32 0.1 Allowed Glycine 0 C--N 1.339 0.701 0 N-CA-C 110.596 -1.002 . . . . 10.0 110.596 -167.951 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.0 tp -68.9 -170.48 0.23 Allowed 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 121.501 0.667 . . . . 10.0 109.708 167.232 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -68.09 -61.01 2.05 Favored 'General case' 0 N--CA 1.472 0.63 0 O-C-N 119.559 -1.963 . . . . 10.0 112.023 -167.323 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -67.97 -40.85 83.07 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.789 1.236 . . . . 10.0 112.041 172.154 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.8 ttt -74.45 120.85 83.47 Favored Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 126.572 1.949 . . . . 10.0 112.594 -174.005 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -63.5 156.9 53.92 Favored 'Trans proline' 0 CA--C 1.541 0.849 0 C-N-CA 122.264 1.976 . . . . 10.0 111.712 -177.558 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 57.6 Cg_endo -57.87 141.85 96.09 Favored 'Trans proline' 0 N--CA 1.459 -0.546 0 C-N-CA 123.296 2.664 . . . . 10.0 110.475 178.143 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 67.23 22.01 72.42 Favored Glycine 0 CA--C 1.532 1.111 0 C-N-CA 120.177 -1.011 . . . . 10.0 113.451 -175.992 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.96 29.48 4.53 Favored Glycine 0 CA--C 1.537 1.418 0 C-N-CA 124.435 1.017 . . . . 10.0 114.462 -176.422 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.9 ttt 75.01 23.87 1.59 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 126.115 1.766 . . . . 10.0 114.382 -178.057 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 36.5 t -95.26 155.9 16.54 Favored 'General case' 0 CA--C 1.541 0.634 0 O-C-N 121.107 -0.995 . . . . 10.0 113.228 -179.086 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 41.4 m -69.75 -82.22 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.125 0.97 . . . . 10.0 112.552 178.627 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.6 t0 -125.49 43.12 3.13 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.421 1.088 . . . . 10.0 110.61 -176.711 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.27 126.96 29.74 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.224 -0.922 . . . . 10.0 111.658 -179.174 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 21.5 m -97.66 -83.49 0.4 Allowed 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.588 -0.523 . . . . 10.0 109.588 179.544 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -156.08 -53.75 0.08 Allowed 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 127.278 2.231 . . . . 10.0 110.162 179.9 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 14.3 pt-20 -51.93 -42.53 62.87 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.08 0.552 . . . . 10.0 111.413 178.018 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -47.43 45.84 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 106.977 -1.49 . . . . 10.0 106.977 -178.045 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -61.24 -52.7 63.68 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.789 1.636 . . . . 10.0 111.798 -173.545 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.0 mttt -66.92 -42.31 85.58 Favored 'General case' 0 C--O 1.22 -0.472 0 C-N-CA 125.055 1.342 . . . . 10.0 109.083 178.761 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -54.6 -35.46 63.41 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 119.448 1.022 . . . . 10.0 112.772 170.746 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -72.9 -47.01 49.49 Favored 'General case' 0 N--CA 1.468 0.434 0 O-C-N 120.293 -1.504 . . . . 10.0 111.099 177.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 23.1 mt -63.61 -37.61 80.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.982 1.313 . . . . 10.0 112.309 177.148 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -71.42 -30.33 65.94 Favored 'General case' 0 C--O 1.231 0.088 0 C-N-CA 124.606 1.162 . . . . 10.0 111.152 176.411 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -53.44 -30.09 38.76 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 112.927 0.714 . . . . 10.0 112.927 171.288 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 71.0 mtm -90.09 -72.72 0.55 Allowed 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.628 -0.67 . . . . 10.0 112.629 178.692 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -158.49 37.73 0.24 Allowed 'General case' 0 N--CA 1.471 0.619 0 O-C-N 121.765 -0.584 . . . . 10.0 112.497 176.24 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 15.7 ptmt 40.66 56.5 2.79 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 126.057 1.743 . . . . 10.0 114.665 172.489 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.519 ' HB2' ' HG ' ' A' ' 35' ' ' LEU . . . -159.72 -78.35 0.06 Allowed 'General case' 0 C--O 1.225 -0.2 0 C-N-CA 124.371 1.068 . . . . 10.0 111.357 170.211 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.446 ' HE3' ' CG ' ' A' ' 23' ' ' PRO . 0.0 OUTLIER . . . . . 0 C--O 1.242 0.666 0 N-CA-C 113.003 0.742 . . . . 10.0 113.003 -176.602 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.532 HMB1 HBB3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.972 0 CA-C-O 118.627 -0.701 . . . . 10.0 110.448 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -163.51 41.97 0.1 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-O 122.247 1.022 . . . . 10.0 111.014 -171.723 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.27 74.32 1.09 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 127.749 2.419 . . . . 10.0 108.737 179.211 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -114.82 -21.1 10.32 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 114.848 1.425 . . . . 10.0 114.848 172.781 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -156.52 120.49 4.37 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 121.613 0.721 . . . . 10.0 109.605 179.85 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -43.97 -39.14 3.87 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 114.741 1.386 . . . . 10.0 114.741 170.158 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -56.62 -47.95 78.53 Favored 'General case' 0 C--N 1.341 0.219 0 O-C-N 121.874 -0.516 . . . . 10.0 110.51 172.365 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.23 -33.09 73.76 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.837 -0.539 . . . . 10.0 110.87 179.892 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 12.8 mm -65.17 -52.07 57.62 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 N-CA-C 108.991 -0.744 . . . . 10.0 108.991 176.147 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -68.57 -41.78 79.23 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 118.144 -1.422 . . . . 10.0 111.438 -178.244 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -68.79 -22.64 64.26 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.08 1.352 . . . . 10.0 112.473 -176.756 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -94.42 -28.41 15.52 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 114.081 1.141 . . . . 10.0 114.081 168.676 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.23 -63.84 1.25 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.14 0.976 . . . . 10.0 113.005 -171.749 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 m -76.4 35.6 0.15 Allowed 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 125.198 1.399 . . . . 10.0 111.04 -178.303 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.4 t -124.94 -1.57 7.81 Favored 'General case' 0 N--CA 1.46 0.054 0 C-N-CA 124.97 1.308 . . . . 10.0 113.779 -163.74 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.2 t -104.56 -47.83 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 C-N-CA 124.783 1.233 . . . . 10.0 108.957 -173.016 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.5 m -84.33 -65.53 1.0 Allowed 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.186 1.395 . . . . 10.0 110.717 172.05 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 53.4 m-70 -74.4 -20.81 59.92 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 115.169 1.544 . . . . 10.0 115.169 -163.004 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 4.6 m -64.73 -44.64 89.5 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 118.392 0.542 . . . . 10.0 110.979 176.845 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 21.8 mmt -102.17 -22.88 14.11 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.819 1.247 . . . . 10.0 111.899 -177.057 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.13 41.7 6.96 Favored Glycine 0 CA--C 1.533 1.21 0 C-N-CA 124.094 0.854 . . . . 10.0 111.931 -175.169 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 84.7 t -87.6 159.81 2.99 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 C-N-CA 124.459 1.104 . . . . 10.0 109.417 179.076 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 59.63 16.17 5.21 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 124.938 1.295 . . . . 10.0 113.571 -174.342 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.92 16.18 80.24 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 124.212 0.91 . . . . 10.0 113.361 -172.803 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -66.78 132.79 94.0 Favored Pre-proline 0 CA--C 1.544 0.721 0 CA-C-N 118.649 1.224 . . . . 10.0 113.339 -174.55 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -66.11 140.85 61.25 Favored 'Trans proline' 0 N--CA 1.459 -0.522 0 C-N-CA 123.788 2.992 . . . . 10.0 111.206 -178.589 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -66.36 145.21 55.97 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-O 121.809 0.814 . . . . 10.0 112.353 -166.712 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 60.9 p -51.34 -37.64 48.91 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.39 1.076 . . . . 10.0 113.275 176.455 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -122.19 40.88 3.54 Favored 'General case' 0 CA--C 1.54 0.592 0 N-CA-C 114.398 1.258 . . . . 10.0 114.398 -174.598 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -85.03 165.35 17.61 Favored 'General case' 0 CA--C 1.54 0.573 0 O-C-N 121.425 -0.797 . . . . 10.0 112.099 174.103 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.2 t -104.34 -34.94 8.13 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 122.427 0.291 . . . . 10.0 111.415 165.663 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.43 -33.64 60.94 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 120.787 -1.195 . . . . 10.0 113.035 -174.689 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 33.6 m-20 -73.15 -28.9 62.5 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.105 0.479 . . . . 10.0 110.366 179.305 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 69.7 m95 -91.67 -35.46 14.18 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.764 2.026 . . . . 10.0 110.938 -174.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -40.28 -63.17 0.76 Allowed Pre-proline 0 CA--C 1.547 0.832 0 N-CA-C 115.038 1.496 . . . . 10.0 115.038 174.173 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -66.19 -6.12 13.98 Favored 'Trans proline' 0 CA--C 1.539 0.754 0 C-N-CA 122.867 2.378 . . . . 10.0 113.497 -178.664 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.519 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 5.5 mmt85 -98.98 -45.63 5.89 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.977 1.711 . . . . 10.0 108.994 -177.916 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.77 -24.39 63.51 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 126.818 2.047 . . . . 10.0 110.702 177.556 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -77.47 -28.53 52.36 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 124.366 1.066 . . . . 10.0 109.747 176.378 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 46.8 mmtt -77.38 -52.5 9.04 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 122.5 0.32 . . . . 10.0 110.519 172.654 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.465 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 164.63 -106.8 0.28 Allowed Glycine 0 CA--C 1.531 1.061 0 C-N-CA 123.558 0.599 . . . . 10.0 111.75 172.823 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -153.83 -61.58 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.358 0 C-N-CA 123.971 0.908 . . . . 10.0 109.413 177.405 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.482 ' HA ' HG12 ' A' ' 43' ' ' VAL . 1.3 m-20 -72.6 24.52 0.06 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.035 1.334 . . . . 10.0 113.242 -171.53 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.465 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.0 OUTLIER -106.57 -25.64 11.73 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 127.705 2.402 . . . . 10.0 108.822 -176.767 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.409 HD22 ' HB2' ' A' ' 41' ' ' ASN . 3.5 mm? -99.52 -42.48 6.91 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.892 1.277 . . . . 10.0 110.85 178.948 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.482 HG12 ' HA ' ' A' ' 40' ' ' ASP . 2.7 p -53.25 -35.74 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.479 0 C-N-CA 122.884 0.474 . . . . 10.0 111.069 171.985 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.2 ptmt -59.93 -43.6 94.85 Favored 'General case' 0 CA--C 1.536 0.405 0 O-C-N 120.717 -1.239 . . . . 10.0 112.419 171.767 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.7 m -72.46 -33.78 67.27 Favored 'General case' 0 N--CA 1.453 -0.309 0 O-C-N 121.692 -0.63 . . . . 10.0 110.72 -176.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -57.77 -47.57 85.62 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.137 0 O-C-N 122.067 -0.396 . . . . 10.0 111.197 172.617 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.75 -30.8 71.11 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 120.788 0.328 . . . . 10.0 111.725 177.005 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.89 -35.95 64.72 Favored 'General case' 0 CA--C 1.537 0.464 0 N-CA-C 113.535 0.939 . . . . 10.0 113.535 179.386 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.47 109.25 0.53 Allowed Glycine 0 CA--C 1.529 0.947 0 N-CA-C 111.254 -0.738 . . . . 10.0 111.254 -167.175 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.71 -154.79 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.139 0.975 . . . . 10.0 109.147 168.959 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -73.04 -66.53 0.66 Allowed 'General case' 0 N--CA 1.479 0.978 0 O-C-N 119.231 -2.168 . . . . 10.0 111.557 -174.875 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.35 -21.48 61.3 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.329 1.052 . . . . 10.0 111.801 174.396 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 1.4 mtm -84.87 125.2 71.44 Favored Pre-proline 0 CA--C 1.538 0.511 0 N-CA-C 112.525 0.565 . . . . 10.0 112.525 -179.668 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -69.51 150.09 69.27 Favored 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 122.063 1.842 . . . . 10.0 111.194 -179.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -60.8 115.07 2.44 Favored 'Trans proline' 0 N--CA 1.456 -0.712 0 C-N-CA 123.342 2.695 . . . . 10.0 109.817 179.669 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 95.5 10.78 56.56 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 121.309 -0.472 . . . . 10.0 113.559 -175.479 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.98 53.49 7.42 Favored Glycine 0 CA--C 1.536 1.391 0 CA-C-N 118.508 1.154 . . . . 10.0 113.233 175.156 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 83.02 -41.02 0.1 Allowed 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 127.012 2.125 . . . . 10.0 112.588 -176.797 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 20.0 t -78.88 176.46 9.57 Favored 'General case' 0 CA--C 1.541 0.617 0 O-C-N 121.677 -0.64 . . . . 10.0 110.857 174.437 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 33.0 p -125.17 -73.59 0.63 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.912 1.285 . . . . 10.0 108.282 167.644 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -79.02 58.99 2.56 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.632 1.973 . . . . 10.0 110.439 -179.112 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 25.6 m -109.4 143.82 38.44 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.196 0.998 . . . . 10.0 112.729 169.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 98.8 m -125.83 151.09 47.28 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 125.389 1.476 . . . . 10.0 109.922 -178.781 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -39.59 -38.41 0.6 Allowed 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 126.7 2.0 . . . . 10.0 114.82 179.719 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -35.33 -53.24 0.64 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.867 1.267 . . . . 10.0 114.349 168.362 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -99.63 -26.51 14.06 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.515 1.526 . . . . 10.0 113.274 171.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.17 -50.38 40.9 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 120.391 -1.443 . . . . 10.0 110.665 -176.187 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.9 tttt -67.58 -50.71 57.04 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 123.794 0.838 . . . . 10.0 108.909 179.606 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -49.11 -26.08 2.51 Favored 'General case' 0 CA--C 1.544 0.723 0 N-CA-C 113.512 0.93 . . . . 10.0 113.512 173.413 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.69 -39.38 20.24 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 124.893 1.277 . . . . 10.0 110.676 -179.839 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.419 HD11 HMB2 ' A' ' 90' ' ' HEC . 3.5 mt -72.85 -45.99 54.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 125.456 1.502 . . . . 10.0 111.789 177.651 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.84 -26.61 67.74 Favored 'General case' 0 C--N 1.33 -0.251 0 C-N-CA 124.434 1.094 . . . . 10.0 112.73 177.229 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -53.43 -28.54 30.57 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.399 0.889 . . . . 10.0 113.399 169.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 62.7 mtm -87.59 -78.05 0.32 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.69 0.796 . . . . 10.0 112.104 179.676 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.4 t -153.37 37.61 0.48 Allowed 'General case' 0 N--CA 1.468 0.449 0 O-C-N 121.823 -0.548 . . . . 10.0 111.588 176.255 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 18.3 ptmt 32.78 66.14 0.21 Allowed 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 126.532 1.933 . . . . 10.0 114.915 174.669 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.519 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -160.09 -53.86 0.06 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 113.419 0.896 . . . . 10.0 113.419 -176.959 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.478 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.24 0.604 0 C-N-CA 126.15 1.78 . . . . 10.0 111.344 -179.704 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.712 HMC1 ' CBC' ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.979 0 CA-C-O 117.96 -1.019 . . . . 10.0 110.048 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -163.34 55.68 0.18 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-O 122.191 0.995 . . . . 10.0 110.702 -168.862 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -129.68 39.8 3.67 Favored 'General case' 0 C--O 1.221 -0.413 0 C-N-CA 124.601 1.161 . . . . 10.0 112.734 -178.827 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -99.07 -23.94 15.08 Favored 'General case' 0 CA--C 1.534 0.337 0 N-CA-C 113.625 0.972 . . . . 10.0 113.625 -175.405 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -142.98 128.78 19.37 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.112 -1.07 . . . . 10.0 108.112 171.754 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -52.87 -38.31 61.45 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.44 1.096 . . . . 10.0 112.983 172.128 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -56.61 -48.7 76.9 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-O 120.781 0.324 . . . . 10.0 110.275 170.206 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.91 -32.22 70.42 Favored 'General case' 0 CA--C 1.528 0.103 0 O-C-N 121.696 -0.627 . . . . 10.0 111.72 -177.611 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.434 ' CD1' ' HB3' ' A' ' 66' ' ' ASP . 36.0 mt -64.76 -52.96 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 N-CA-C 107.328 -1.36 . . . . 10.0 107.328 176.252 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.473 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -69.38 -42.52 75.06 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 117.934 -1.506 . . . . 10.0 111.457 -176.298 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.8 t30 -70.49 -24.03 62.78 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.689 1.595 . . . . 10.0 113.148 -176.618 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.14 -31.29 19.24 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.12 0.873 . . . . 10.0 111.984 167.604 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.594 ' O ' HMC3 ' A' ' 90' ' ' HEC . . . -102.4 -68.23 0.84 Allowed 'General case' 0 N--CA 1.462 0.172 0 N-CA-C 114.094 1.146 . . . . 10.0 114.094 -171.773 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.473 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -77.82 41.12 0.34 Allowed 'General case' 0 CA--C 1.554 1.107 0 CA-C-O 123.176 1.465 . . . . 10.0 109.238 -174.922 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.0 t -123.99 -10.23 7.67 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 126.34 1.856 . . . . 10.0 112.701 -164.644 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 49.2 t -92.97 -51.62 11.01 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.768 0 C-N-CA 125.401 1.48 . . . . 10.0 108.102 -177.215 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 55.7 m -95.14 -57.12 2.51 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.701 1.601 . . . . 10.0 109.816 -171.771 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -73.15 -23.98 60.53 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.001 0.92 . . . . 10.0 112.914 -169.789 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.7 t -62.46 -40.43 96.61 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.799 0.809 . . . . 10.0 111.332 -173.802 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.3 tpt -118.77 -32.49 4.51 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 125.564 1.545 . . . . 10.0 112.337 -178.198 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.82 58.9 1.55 Allowed Glycine 0 CA--C 1.534 1.252 0 C-N-CA 124.704 1.145 . . . . 10.0 113.343 -176.687 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 96.0 t -82.35 -57.44 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 O-C-N 121.637 -0.92 . . . . 10.0 112.625 -176.581 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.05 31.22 0.38 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.035 0.934 . . . . 10.0 111.113 179.78 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 62.28 25.78 67.03 Favored Glycine 0 CA--C 1.535 1.298 0 C-N-CA 123.763 0.696 . . . . 10.0 112.552 -169.781 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.78 148.22 96.47 Favored Pre-proline 0 CA--C 1.54 0.578 0 O-C-N 122.015 -0.697 . . . . 10.0 111.467 177.079 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -77.62 142.4 20.51 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 123.287 2.658 . . . . 10.0 111.709 -171.15 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -52.39 130.18 30.58 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 114.347 1.24 . . . . 10.0 114.347 -172.295 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.0 m -17.33 -74.04 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 128.922 2.889 . . . . 10.0 115.627 -177.843 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 7.8 p-80 -146.16 115.18 6.97 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 109.107 -0.701 . . . . 10.0 109.107 169.499 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 4.6 p30 -143.79 -175.74 4.7 Favored 'General case' 0 N--CA 1.443 -0.79 0 C-N-CA 124.325 1.05 . . . . 10.0 110.182 176.532 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 11.0 t -102.96 -30.0 11.06 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 112.728 0.64 . . . . 10.0 112.728 170.014 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -60.47 -52.56 64.69 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 119.892 -1.755 . . . . 10.0 114.452 -173.98 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.429 ' OD1' ' NZ ' ' A' ' 78' ' ' LYS . 9.5 t0 -77.8 -22.07 50.65 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.319 1.848 . . . . 10.0 110.049 -179.777 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.4 ' CE3' ' HB2' ' A' ' 75' ' ' SER . 54.3 m95 -86.74 -25.44 24.7 Favored 'General case' 0 CA--C 1.553 1.088 0 O-C-N 121.134 -0.979 . . . . 10.0 112.485 177.83 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -49.47 -56.91 13.75 Favored Pre-proline 0 CA--C 1.54 0.586 0 O-C-N 120.543 -1.348 . . . . 10.0 113.096 174.874 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -69.7 9.75 0.55 Allowed 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 122.457 2.104 . . . . 10.0 113.612 178.322 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 4.6 mmt180 -110.31 -49.97 3.01 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.477 1.511 . . . . 10.0 108.687 173.784 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 16.8 mt -63.43 9.01 0.06 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.51 1.924 . . . . 10.0 114.65 171.043 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -95.93 -29.16 14.32 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.406 1.482 . . . . 10.0 110.6 175.813 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 16.9 mmtt -92.47 -54.13 3.92 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 124.143 0.977 . . . . 10.0 109.968 179.844 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.435 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 166.72 -139.69 5.89 Favored Glycine 0 CA--C 1.533 1.167 0 N-CA-C 110.725 -0.95 . . . . 10.0 110.725 -178.543 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 60.5 t -132.75 -63.15 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 C-N-CA 124.418 1.087 . . . . 10.0 109.545 -175.504 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -65.66 10.15 0.11 Allowed 'General case' 0 CA--C 1.556 1.188 0 C-N-CA 125.98 1.712 . . . . 10.0 114.025 -176.447 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.435 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -90.63 -19.55 23.54 Favored 'General case' 0 C--N 1.341 0.201 0 C-N-CA 128.455 2.702 . . . . 10.0 111.48 176.743 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 mt -106.48 -41.19 5.35 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.627 1.171 . . . . 10.0 109.028 -171.381 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 1.5 p -51.53 -37.0 18.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 C-N-CA 123.049 0.54 . . . . 10.0 111.556 168.227 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.3 ptmt -62.79 -39.22 93.56 Favored 'General case' 0 CA--C 1.543 0.677 0 O-C-N 121.022 -1.049 . . . . 10.0 113.285 171.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.9 m -70.3 -37.65 74.84 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 121.039 -1.038 . . . . 10.0 110.656 -179.67 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.475 HG22 ' HE1' ' A' ' 53' ' ' MET . 14.2 t -52.88 -53.63 20.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 C-N-CA 124.043 0.937 . . . . 10.0 110.395 172.209 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.412 ' HA ' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -59.16 -35.75 74.09 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 112.774 0.657 . . . . 10.0 112.774 176.629 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 63.2 m -72.19 -33.3 67.55 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 118.9 -0.571 . . . . 10.0 112.319 -179.378 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.86 85.1 0.5 Allowed Glycine 0 CA--C 1.533 1.17 0 CA-C-N 119.413 1.006 . . . . 10.0 111.215 -174.019 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.44 172.38 0.34 Allowed 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.655 1.182 . . . . 10.0 111.523 170.307 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 53.6 m-80 -46.85 -57.79 4.57 Favored 'General case' 0 N--CA 1.479 0.993 0 O-C-N 120.802 -1.186 . . . . 10.0 112.992 -170.767 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -102.13 28.26 5.97 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-N 113.647 -1.615 . . . . 10.0 110.585 -179.644 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . 0.475 ' HE1' HG22 ' A' ' 46' ' ' VAL . 3.3 mmm -123.07 129.2 25.05 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.912 1.285 . . . . 10.0 112.484 179.553 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -68.87 157.34 62.23 Favored 'Trans proline' 0 CA--C 1.537 0.654 0 C-N-CA 122.739 2.293 . . . . 10.0 110.825 176.098 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -61.85 132.81 41.52 Favored 'Trans proline' 0 N--CA 1.455 -0.785 0 C-N-CA 122.508 2.139 . . . . 10.0 109.31 -178.679 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.412 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 53.45 41.12 63.0 Favored Glycine 0 C--N 1.338 0.673 0 C-N-CA 121.504 -0.379 . . . . 10.0 112.929 -178.185 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 45.47 50.58 10.34 Favored Glycine 0 CA--C 1.532 1.121 0 N-CA-C 112.062 -0.415 . . . . 10.0 112.062 -179.514 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 65.05 36.72 7.19 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 125.762 1.625 . . . . 10.0 112.808 176.592 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 17.5 t -126.18 148.74 49.37 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 124.293 1.037 . . . . 10.0 111.543 175.319 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 25.4 m -81.54 -75.03 0.3 Allowed 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.259 0.623 . . . . 10.0 111.048 179.407 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -114.27 41.8 2.21 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.879 1.272 . . . . 10.0 111.631 -175.348 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 7.1 m -61.43 136.57 58.08 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.152 -0.968 . . . . 10.0 110.833 171.248 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 28.6 m -107.13 159.04 16.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 125.985 1.714 . . . . 10.0 108.881 175.775 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -44.26 -43.7 7.49 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 114.219 1.192 . . . . 10.0 114.219 175.865 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -51.56 -38.03 52.43 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 112.084 0.401 . . . . 10.0 112.084 176.595 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.434 ' HB3' ' CD1' ' A' ' 6' ' ' ILE . 0.3 OUTLIER -85.41 -48.15 9.28 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 123.922 0.889 . . . . 10.0 111.131 177.039 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 28.9 m-85 -59.11 -52.44 65.73 Favored 'General case' 0 C--N 1.34 0.157 0 O-C-N 121.338 -0.851 . . . . 10.0 111.572 -175.725 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -61.13 -53.16 60.51 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 109.157 -0.683 . . . . 10.0 109.157 -179.563 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.29 -37.12 10.19 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 113.238 0.829 . . . . 10.0 113.238 170.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.34 -43.22 77.96 Favored 'General case' 0 CA--C 1.54 0.596 0 O-C-N 121.095 -1.003 . . . . 10.0 112.373 179.901 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 21.8 pt -76.23 -35.34 27.72 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.69 0 O-C-N 121.34 -0.85 . . . . 10.0 112.729 177.254 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -67.92 -29.31 68.36 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.535 1.534 . . . . 10.0 111.843 171.56 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -54.35 -50.54 67.2 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 120.95 -1.093 . . . . 10.0 110.861 169.696 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 70.1 mtm -65.77 -65.09 0.72 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 122.595 0.358 . . . . 10.0 110.071 178.047 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.4 ' HB2' ' CE3' ' A' ' 31' ' ' TRP . 3.8 m -141.66 -87.4 0.16 Allowed 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.055 -0.35 . . . . 10.0 110.055 175.507 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt 174.34 49.27 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 126.131 1.772 . . . . 10.0 110.855 -176.598 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -168.4 -83.97 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.563 1.319 . . . . 10.0 114.563 179.58 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.429 ' NZ ' ' OD1' ' A' ' 30' ' ' ASP . 0.1 OUTLIER . . . . . 0 C--O 1.251 1.151 0 N-CA-C 114.457 1.28 . . . . 10.0 114.457 -170.639 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.867 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.976 0 CA-C-O 116.957 -1.497 . . . . 10.0 108.388 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -163.12 85.38 0.52 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-O 122.36 1.076 . . . . 10.0 111.416 -168.173 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.62 72.56 1.45 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.545 1.538 . . . . 10.0 110.159 174.999 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -114.28 -19.67 11.18 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 115.137 1.532 . . . . 10.0 115.137 175.684 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 14.3 t0 -161.81 167.91 24.04 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.498 1.519 . . . . 10.0 107.27 -173.553 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.38 -49.02 13.02 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.645 2.378 . . . . 10.0 112.183 172.862 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 tt0 -58.3 -45.92 87.07 Favored 'General case' 0 C--N 1.342 0.275 0 CA-C-O 121.126 0.488 . . . . 10.0 110.599 -179.398 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.29 -34.38 77.85 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 122.04 -0.412 . . . . 10.0 109.962 -176.68 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.473 HD12 ' SG ' ' A' ' 62' ' ' CYS . 4.8 mm -66.45 -50.56 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 118.388 -0.815 . . . . 10.0 110.779 177.009 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -67.1 -39.26 86.7 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 117.011 -1.876 . . . . 10.0 111.048 179.29 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -69.17 -22.45 63.91 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.482 1.513 . . . . 10.0 113.099 -178.107 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.61 -29.13 16.3 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.138 0.975 . . . . 10.0 113.175 170.758 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -112.22 -64.63 1.27 Allowed 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.136 0.974 . . . . 10.0 112.667 -169.286 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.01 42.05 0.24 Allowed 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.893 1.277 . . . . 10.0 110.896 177.834 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.2 t -126.65 -2.5 6.69 Favored 'General case' 0 CA--C 1.521 -0.146 0 C-N-CA 124.948 1.299 . . . . 10.0 114.067 -163.968 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.8 t -102.78 -52.52 8.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 C-N-CA 124.019 0.928 . . . . 10.0 108.861 -174.256 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 10.3 m -81.14 -64.91 1.09 Allowed 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.728 1.611 . . . . 10.0 110.471 175.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 28.8 m-70 -73.65 -13.03 60.93 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.01 1.324 . . . . 10.0 114.534 -163.936 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.8 t -73.51 -38.92 65.18 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 123.161 0.584 . . . . 10.0 110.658 -179.101 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.8 tpt -117.87 -34.32 4.22 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.899 1.279 . . . . 10.0 113.001 -177.039 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.9 52.62 2.06 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.687 1.613 . . . . 10.0 113.414 178.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 84.4 t -75.02 -56.15 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 O-C-N 121.702 -0.881 . . . . 10.0 112.585 -174.452 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.91 33.72 0.44 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 123.74 0.816 . . . . 10.0 111.038 -179.299 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 65.04 21.35 67.81 Favored Glycine 0 CA--C 1.536 1.348 0 C-N-CA 124.406 1.003 . . . . 10.0 112.606 -170.809 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -65.65 140.59 97.5 Favored Pre-proline 0 CA--C 1.546 0.806 0 N-CA-C 113.426 0.899 . . . . 10.0 113.426 -172.559 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -71.56 143.4 42.38 Favored 'Trans proline' 0 CA--C 1.534 0.524 0 C-N-CA 125.217 3.945 . . . . 10.0 111.038 -177.255 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.6 mttt -67.19 145.14 55.54 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.258 -0.901 . . . . 10.0 113.43 -166.136 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 79.0 p -41.03 -40.09 1.36 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 124.714 1.206 . . . . 10.0 113.442 161.499 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -133.06 122.84 24.73 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.939 1.296 . . . . 10.0 110.511 171.706 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -154.69 170.46 21.5 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.867 2.067 . . . . 10.0 107.727 172.58 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.3 m -110.61 -37.99 5.3 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 118.644 0.656 . . . . 10.0 111.93 169.366 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.83 -19.72 37.03 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 120.996 -1.065 . . . . 10.0 112.836 -175.946 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 12.7 t0 -79.1 -35.51 42.17 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 126.455 1.902 . . . . 10.0 110.133 178.575 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.495 ' CH2' ' HB2' ' A' ' 74' ' ' MET . 70.5 m95 -88.48 -37.87 15.44 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 127.802 2.441 . . . . 10.0 112.736 -179.695 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -40.01 -59.96 1.6 Allowed Pre-proline 0 CA--C 1.545 0.773 0 N-CA-C 113.983 1.105 . . . . 10.0 113.983 173.696 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -69.65 22.13 0.17 Allowed 'Trans proline' 0 CA--C 1.546 1.088 0 C-N-CA 124.073 3.182 . . . . 10.0 114.731 178.895 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.624 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 0.0 OUTLIER -125.98 -47.27 1.65 Allowed 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 126.288 1.835 . . . . 10.0 109.854 167.7 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.46 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 1.5 mt -54.81 -5.45 0.09 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 126.316 1.846 . . . . 10.0 114.154 168.142 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -78.35 -31.41 48.56 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 125.194 1.398 . . . . 10.0 109.792 178.245 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 7.3 mttp -91.31 -57.18 2.87 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.79 0.436 . . . . 10.0 110.515 169.531 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.66 -114.52 0.66 Allowed Glycine 0 CA--C 1.528 0.85 0 N-CA-C 111.255 -0.738 . . . . 10.0 111.255 172.643 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -127.04 175.74 8.45 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.085 0 C-N-CA 125.529 1.531 . . . . 10.0 110.612 176.904 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.9 t70 73.45 -42.15 0.51 Allowed 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 125.37 1.468 . . . . 10.0 112.138 -174.381 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -54.89 -20.22 8.34 Favored 'General case' 0 N--CA 1.47 0.548 0 O-C-N 121.262 -0.899 . . . . 10.0 113.192 -176.353 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -103.51 -40.65 6.26 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 125.676 1.59 . . . . 10.0 111.572 178.988 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.513 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.4 OUTLIER -48.27 -35.52 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 124.622 1.169 . . . . 10.0 111.819 167.449 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -66.81 -43.48 83.69 Favored 'General case' 0 CA--C 1.548 0.894 0 O-C-N 120.528 -1.358 . . . . 10.0 114.065 169.115 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 68.5 m -72.34 -34.12 67.8 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 120.643 -1.286 . . . . 10.0 111.522 -176.962 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.513 HG12 ' HA ' ' A' ' 43' ' ' VAL . 9.9 p -68.03 -47.16 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 O-C-N 121.612 -0.68 . . . . 10.0 110.967 174.268 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.25 0.0 OUTLIER -56.07 -41.97 75.93 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.112 0.414 . . . . 10.0 110.822 -179.904 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 32.7 p -72.86 -35.1 67.14 Favored 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 113.115 0.783 . . . . 10.0 113.115 178.491 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 87.15 105.59 0.85 Allowed Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.868 0.758 . . . . 10.0 112.562 -174.743 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -64.87 170.38 4.32 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.151 0.981 . . . . 10.0 111.621 171.053 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.5 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 5.2 m-80 -52.04 -60.36 3.28 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.583 -1.323 . . . . 10.0 113.419 -169.268 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -81.51 15.85 1.92 Allowed 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.692 1.197 . . . . 10.0 112.635 174.167 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 3.9 ttp -125.39 129.72 24.35 Favored Pre-proline 0 CA--C 1.547 0.84 0 N-CA-C 113.834 1.05 . . . . 10.0 113.834 -175.128 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -63.16 156.75 53.42 Favored 'Trans proline' 0 CA--C 1.538 0.721 0 C-N-CA 121.492 1.461 . . . . 10.0 111.636 178.758 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -57.48 139.26 89.61 Favored 'Trans proline' 0 N--CA 1.454 -0.85 0 C-N-CA 122.408 2.072 . . . . 10.0 109.143 177.835 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 60.32 23.23 59.8 Favored Glycine 0 CA--C 1.528 0.858 0 C-N-CA 121.162 -0.542 . . . . 10.0 114.025 -174.378 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 49.66 37.27 26.83 Favored Glycine 0 CA--C 1.535 1.329 0 CA-C-N 118.278 1.039 . . . . 10.0 111.266 -174.272 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER 91.55 -27.13 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.487 2.315 . . . . 10.0 112.871 -176.478 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 19.3 t -95.46 69.82 3.07 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.087 -1.008 . . . . 10.0 113.048 -176.864 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 7.4 m -53.82 -22.06 8.82 Favored 'General case' 0 CA--C 1.544 0.714 0 O-C-N 121.263 -0.898 . . . . 10.0 113.03 170.322 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -78.57 -24.36 45.6 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 127.005 2.122 . . . . 10.0 112.785 -178.677 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . 0.473 ' SG ' HD12 ' A' ' 6' ' ' ILE . 66.4 m -70.66 144.95 50.92 Favored 'General case' 0 N--CA 1.469 0.516 0 O-C-N 120.988 -1.07 . . . . 10.0 112.938 -173.536 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 91.3 m -100.54 -91.09 0.31 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 118.412 0.551 . . . . 10.0 110.526 -174.394 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -152.45 -50.03 0.11 Allowed 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 124.702 1.201 . . . . 10.0 109.57 179.154 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 22.8 mt-10 -52.96 -57.84 8.96 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 121.342 -0.849 . . . . 10.0 112.844 175.625 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -74.16 -28.61 61.39 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.443 1.02 . . . . 10.0 110.23 -179.021 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.28 -53.81 38.49 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.566 1.146 . . . . 10.0 111.206 -177.327 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 4.0 pttp -62.67 -49.73 73.97 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 107.362 -1.347 . . . . 10.0 107.362 179.426 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -52.95 -34.94 57.85 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.118 0.567 . . . . 10.0 112.247 175.811 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -63.51 -49.82 72.02 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.644 -0.66 . . . . 10.0 110.684 177.718 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 7.0 mt -67.65 -40.83 84.77 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.724 0 CA-C-O 121.347 0.594 . . . . 10.0 111.768 176.572 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -57.83 -37.29 73.57 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.928 1.291 . . . . 10.0 111.435 172.804 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -54.26 -44.63 71.97 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.733 0.642 . . . . 10.0 112.733 176.796 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.495 ' HB2' ' CH2' ' A' ' 31' ' ' TRP . 1.2 mpp? -69.19 -74.05 0.14 Allowed 'General case' 0 CA--C 1.541 0.613 0 O-C-N 122.095 -0.378 . . . . 10.0 111.902 179.274 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 1.3 t -161.0 37.76 0.15 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.246 0.619 . . . . 10.0 112.3 178.496 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . 0.255 2.5 ptpt 42.51 55.36 4.17 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.554 1.942 . . . . 10.0 114.741 174.613 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.624 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -158.86 -87.4 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 CA-C-N 115.505 -0.77 . . . . 10.0 112.372 178.437 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.543 ' HA ' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.033 0 N-CA-C 115.687 1.736 . . . . 10.0 115.687 -163.512 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.762 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.965 0 N-CA-C 108.514 -0.921 . . . . 10.0 108.514 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -164.47 105.11 0.85 Allowed 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.911 0.862 . . . . 10.0 111.264 -144.424 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . 0.481 HD12 HG13 ' A' ' 6' ' ' ILE . 1.6 tp -75.08 69.41 1.97 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.122 0.969 . . . . 10.0 110.257 174.846 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -110.19 -25.02 10.39 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.904 1.282 . . . . 10.0 112.221 174.83 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 53.0 t0 -147.03 112.69 5.66 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 124.028 0.931 . . . . 10.0 109.072 174.746 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -38.29 -41.64 0.63 Allowed 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 115.274 1.583 . . . . 10.0 115.274 166.155 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -58.04 -48.29 80.55 Favored 'General case' 0 C--N 1.344 0.339 0 CA-C-N 119.121 0.873 . . . . 10.0 110.404 171.399 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.22 -33.22 74.9 Favored 'General case' 0 N--CA 1.457 -0.122 0 O-C-N 121.795 -0.566 . . . . 10.0 110.37 -178.228 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.481 HG13 HD12 ' A' ' -1' ' ' LEU . 15.9 mm -65.84 -50.79 68.06 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.133 0 CA-C-O 118.46 -0.781 . . . . 10.0 109.94 174.831 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.471 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -67.58 -40.39 84.83 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 117.379 -1.729 . . . . 10.0 111.15 -178.772 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -69.4 -22.68 63.68 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 125.971 1.708 . . . . 10.0 112.922 -178.704 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -92.69 -29.18 16.2 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.648 1.179 . . . . 10.0 113.206 170.663 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.92 -63.78 1.36 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.443 1.097 . . . . 10.0 112.734 -170.732 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.471 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -75.51 40.32 0.17 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.908 1.283 . . . . 10.0 111.131 178.962 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.7 t -127.6 1.57 6.17 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 114.254 1.205 . . . . 10.0 114.254 -164.158 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 45.7 t -96.75 -42.38 11.95 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 C-N-CA 124.918 1.287 . . . . 10.0 108.399 -179.139 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 61.2 m -105.33 -58.96 1.82 Allowed 'General case' 0 N--CA 1.447 -0.623 0 C-N-CA 126.666 1.986 . . . . 10.0 109.506 -169.428 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 85.5 m-70 -74.26 -26.21 60.08 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 113.88 1.067 . . . . 10.0 113.88 -172.267 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 3.0 m -59.55 -47.86 83.9 Favored 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 123.415 0.686 . . . . 10.0 111.292 -177.961 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.6 tpt -106.83 -23.74 12.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.634 0.773 . . . . 10.0 111.932 -179.938 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.04 57.99 1.63 Allowed Glycine 0 CA--C 1.535 1.323 0 C-N-CA 123.866 0.746 . . . . 10.0 112.234 -173.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 51.6 t -105.62 161.02 5.38 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 125.842 1.657 . . . . 10.0 109.518 -179.836 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 55.89 26.61 9.94 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.253 1.021 . . . . 10.0 112.693 -175.163 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.8 11.09 84.83 Favored Glycine 0 CA--C 1.535 1.329 0 C-N-CA 124.622 1.106 . . . . 10.0 113.944 -176.46 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.3 142.43 92.44 Favored Pre-proline 0 CA--C 1.548 0.87 0 CA-C-N 118.926 1.363 . . . . 10.0 113.761 -173.172 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -75.13 152.13 39.78 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 125.145 3.897 . . . . 10.0 110.529 -178.416 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.78 141.94 38.57 Favored 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 112.625 0.602 . . . . 10.0 112.625 -165.809 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.6 p -79.07 50.26 1.02 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.351 1.461 . . . . 10.0 113.43 -179.052 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -146.72 -39.71 0.21 Allowed 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 115.623 1.712 . . . . 10.0 115.623 177.361 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -73.88 153.94 39.65 Favored 'General case' 0 C--O 1.226 -0.163 0 N-CA-C 108.211 -1.033 . . . . 10.0 108.211 179.289 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 34.1 m -96.13 -30.17 13.67 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 119.485 1.039 . . . . 10.0 110.267 174.251 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.39 -31.28 63.7 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 114.787 1.403 . . . . 10.0 114.787 -178.951 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -77.1 -31.41 55.84 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-O 121.792 0.806 . . . . 10.0 111.539 178.055 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.513 ' CZ2' ' HE3' ' A' ' 78' ' ' LYS . 59.9 m95 -85.99 -33.6 21.04 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.119 2.167 . . . . 10.0 112.266 -178.265 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -46.94 -56.54 11.52 Favored Pre-proline 0 CA--C 1.546 0.814 0 C-N-CA 125.35 1.46 . . . . 10.0 113.424 175.5 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.35 14.97 0.21 Allowed 'Trans proline' 0 CA--C 1.542 0.905 0 C-N-CA 123.321 2.681 . . . . 10.0 114.016 178.351 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -117.32 -52.65 2.48 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.014 1.726 . . . . 10.0 109.357 167.073 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.422 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.4 OUTLIER -61.77 -19.2 62.22 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.642 1.577 . . . . 10.0 112.588 -179.204 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.13 -35.27 25.72 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 125.064 1.345 . . . . 10.0 109.601 -178.754 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.3 mmtp -72.4 -50.36 27.0 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 116.298 -0.41 . . . . 10.0 110.175 171.12 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.496 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 162.68 -130.21 2.21 Favored Glycine 0 CA--C 1.533 1.177 0 N-CA-C 111.237 -0.745 . . . . 10.0 111.237 177.298 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 3.1 t -136.29 -58.84 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 123.753 0.821 . . . . 10.0 109.442 -178.01 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.67 11.08 0.06 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.607 1.963 . . . . 10.0 114.285 -177.701 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.496 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.2 OUTLIER -96.43 -20.97 18.04 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 127.104 2.161 . . . . 10.0 110.837 178.577 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -100.26 -41.56 7.03 Favored 'General case' 0 N--CA 1.456 -0.164 0 C-N-CA 123.108 0.563 . . . . 10.0 111.352 -178.65 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 4.0 p -52.89 -35.71 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.706 0 CA-C-O 121.279 0.562 . . . . 10.0 111.188 172.564 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.3 ptmt -64.77 -43.75 92.25 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 113.954 1.094 . . . . 10.0 113.954 170.303 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.8 -36.7 81.87 Favored 'General case' 0 N--CA 1.465 0.305 0 O-C-N 121.017 -1.052 . . . . 10.0 109.78 177.128 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 23.0 t -60.1 -57.89 9.73 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.837 0 C-N-CA 123.067 0.547 . . . . 10.0 110.385 176.139 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -55.84 -34.53 65.5 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 112.885 0.698 . . . . 10.0 112.885 177.579 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 59.5 m -72.05 -35.94 69.47 Favored 'General case' 0 CA--C 1.54 0.565 0 N-CA-C 112.835 0.68 . . . . 10.0 112.835 176.014 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 83.61 109.74 0.54 Allowed Glycine 0 CA--C 1.536 1.384 0 CA-C-N 119.324 0.966 . . . . 10.0 112.16 -173.027 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.55 -174.45 3.39 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.304 1.042 . . . . 10.0 111.412 175.322 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -51.58 -55.37 19.55 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 123.317 1.532 . . . . 10.0 112.973 -167.165 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -113.14 34.2 4.62 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-N 111.575 -2.557 . . . . 10.0 108.915 -176.758 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 44.9 ttp -138.46 123.75 12.2 Favored Pre-proline 0 CA--C 1.546 0.801 0 N-CA-C 112.159 0.429 . . . . 10.0 112.159 177.799 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -65.91 160.79 42.41 Favored 'Trans proline' 0 CA--C 1.539 0.75 0 C-N-CA 122.688 2.259 . . . . 10.0 111.963 -177.739 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -59.57 127.43 23.67 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 122.784 2.323 . . . . 10.0 109.891 -178.654 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 76.64 10.58 85.81 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 114.403 0.521 . . . . 10.0 114.403 -173.16 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 62.18 30.54 76.13 Favored Glycine 0 CA--C 1.54 1.624 0 CA-C-N 119.199 1.499 . . . . 10.0 112.697 -178.761 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 80.25 55.15 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 126.815 2.046 . . . . 10.0 111.549 176.137 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -127.69 167.24 16.72 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.907 1.683 . . . . 10.0 110.956 178.082 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 93.2 m -118.02 -89.28 0.59 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.861 0.864 . . . . 10.0 110.528 176.987 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 27.7 t0 -93.2 66.31 4.03 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 124.444 1.098 . . . . 10.0 109.148 -176.034 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 53.7 m -120.92 129.14 53.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 115.119 -0.946 . . . . 10.0 111.606 -170.744 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 81.2 m -125.64 145.77 50.01 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 123.666 0.786 . . . . 10.0 110.789 -172.597 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -32.75 -43.2 0.09 Allowed 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 128.025 2.53 . . . . 10.0 113.932 176.71 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -28.58 -62.04 0.11 Allowed 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 126.839 2.056 . . . . 10.0 114.321 164.946 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -101.82 -28.19 12.58 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.489 1.116 . . . . 10.0 112.178 178.581 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -51.89 -41.58 62.05 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 120.826 -1.171 . . . . 10.0 112.085 170.753 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.424 ' HG3' ' N ' ' A' ' 69' ' ' ALA . 51.4 pttt -62.56 -55.7 24.78 Favored 'General case' 0 C--O 1.22 -0.472 0 N-CA-C 107.744 -1.206 . . . . 10.0 107.744 175.681 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.424 ' N ' ' HG3' ' A' ' 68' ' ' LYS . . . -51.38 -33.22 29.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.809 0.844 . . . . 10.0 111.31 -179.71 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.37 -38.85 78.24 Favored 'General case' 0 C--O 1.222 -0.382 0 C-N-CA 123.764 0.826 . . . . 10.0 111.749 -179.284 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 10.4 mt -79.4 -47.3 22.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.752 0 C-N-CA 125.355 1.462 . . . . 10.0 111.036 174.937 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -48.25 -42.66 31.11 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 127.116 2.166 . . . . 10.0 112.049 171.428 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -44.41 -44.47 8.39 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 123.648 0.779 . . . . 10.0 112.185 175.882 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.499 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 3.2 mpp? -75.32 -70.7 0.41 Allowed 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.696 0.284 . . . . 10.0 111.435 -179.971 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -161.71 32.59 0.13 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.155 0.798 . . . . 10.0 113.155 -178.923 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 39.42 55.36 2.3 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.088 1.355 . . . . 10.0 113.577 -179.098 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.444 ' HB3' ' HE3' ' A' ' 31' ' ' TRP . . . -140.08 -61.85 0.52 Allowed 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 115.532 -0.758 . . . . 10.0 112.372 178.78 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.513 ' HE3' ' CZ2' ' A' ' 31' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.731 0 N-CA-C 115.202 1.556 . . . . 10.0 115.202 -163.967 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.835 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 117.066 -1.445 . . . . 10.0 108.85 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 29.0 t0 -160.85 44.6 0.18 Allowed 'General case' 0 CA--C 1.543 0.708 0 CA-C-O 123.381 1.562 . . . . 10.0 108.994 179.619 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -146.0 74.18 1.37 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 127.28 2.232 . . . . 10.0 107.878 -178.375 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -115.38 -20.79 10.14 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.131 1.16 . . . . 10.0 114.131 171.677 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 t0 -156.61 159.87 38.88 Favored 'General case' 0 N--CA 1.445 -0.708 0 C-N-CA 125.529 1.532 . . . . 10.0 107.356 -174.95 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -79.51 -41.96 26.25 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 128.061 2.545 . . . . 10.0 112.082 179.116 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -57.14 -48.6 78.28 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 121.428 0.632 . . . . 10.0 109.702 175.011 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.91 -33.86 76.51 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.092 -0.504 . . . . 10.0 110.345 -175.63 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 13.0 mt -65.2 -52.22 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.168 0 CA-C-O 118.798 -0.62 . . . . 10.0 109.699 176.221 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.42 -38.12 80.92 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 117.142 -1.823 . . . . 10.0 111.313 -177.975 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -69.22 -22.48 63.87 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.69 1.596 . . . . 10.0 113.134 -179.438 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -95.94 -28.41 14.69 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.999 0.92 . . . . 10.0 113.241 170.631 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.1 -66.33 1.08 Allowed 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.439 1.096 . . . . 10.0 112.474 -171.187 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.15 43.24 0.21 Allowed 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 124.781 1.232 . . . . 10.0 111.127 178.12 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.8 t -129.24 -6.62 4.83 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 125.195 1.398 . . . . 10.0 113.816 -164.886 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.6 t -94.79 -43.98 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.555 0 C-N-CA 124.052 0.941 . . . . 10.0 108.781 -175.245 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 22.0 m -104.43 -54.55 2.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 125.671 1.589 . . . . 10.0 109.257 -169.713 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -73.59 -13.41 61.01 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.351 1.46 . . . . 10.0 114.081 -172.896 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 6.3 t -73.01 -43.25 62.36 Favored 'General case' 0 CA--C 1.535 0.384 0 O-C-N 121.77 -0.581 . . . . 10.0 110.494 -178.144 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 16.3 tpp -112.18 -37.5 5.02 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.936 1.294 . . . . 10.0 112.999 179.917 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.98 58.98 1.27 Allowed Glycine 0 CA--C 1.534 1.268 0 C-N-CA 125.236 1.398 . . . . 10.0 113.461 -178.591 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 89.7 t -79.8 -60.28 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 O-C-N 121.615 -0.932 . . . . 10.0 112.711 -175.431 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -82.47 30.74 0.41 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.716 0.806 . . . . 10.0 111.171 178.884 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 75.57 6.69 81.72 Favored Glycine 0 CA--C 1.536 1.381 0 C-N-CA 124.348 0.975 . . . . 10.0 113.58 -173.466 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -55.43 135.83 69.97 Favored Pre-proline 0 CA--C 1.544 0.732 0 CA-C-N 118.07 0.935 . . . . 10.0 112.529 -176.272 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.8 Cg_endo -69.36 149.83 69.93 Favored 'Trans proline' 0 N--CA 1.458 -0.568 0 C-N-CA 123.917 3.078 . . . . 10.0 111.111 -175.335 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.63 134.48 39.3 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.156 0.583 . . . . 10.0 110.871 -163.985 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 94.8 p -39.7 -41.33 1.06 Allowed 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 125.006 1.323 . . . . 10.0 114.1 178.142 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 26.6 p-80 -131.94 113.64 13.67 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 126.033 1.733 . . . . 10.0 109.701 173.094 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -149.53 162.19 40.64 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.927 1.691 . . . . 10.0 107.682 174.167 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 99.5 m -107.53 -37.08 6.29 Favored 'General case' 0 N--CA 1.473 0.712 0 CA-C-N 118.596 0.635 . . . . 10.0 111.686 170.127 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.36 -24.94 39.45 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 121.188 -0.945 . . . . 10.0 112.629 -176.76 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -77.33 -39.0 49.19 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 125.699 1.6 . . . . 10.0 108.947 177.879 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.461 ' CH2' ' HG3' ' A' ' 78' ' ' LYS . 60.1 m95 -80.87 -34.83 33.39 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.21 1.804 . . . . 10.0 112.427 179.568 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -40.18 -61.1 1.23 Allowed Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 115.033 1.494 . . . . 10.0 115.033 172.798 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -68.42 -4.67 13.38 Favored 'Trans proline' 0 CA--C 1.537 0.629 0 C-N-CA 123.333 2.689 . . . . 10.0 113.897 -179.014 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.0 -47.97 6.74 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.124 0.97 . . . . 10.0 108.652 172.234 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.72 16.76 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.83 1.652 . . . . 10.0 115.277 171.699 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -89.01 -24.05 22.45 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 120.99 -1.069 . . . . 10.0 110.835 -178.071 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.7 mptt -101.16 -48.78 4.29 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.024 0.93 . . . . 10.0 109.868 173.632 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 149.5 -124.73 1.85 Allowed Glycine 0 CA--C 1.528 0.855 0 N-CA-C 110.412 -1.075 . . . . 10.0 110.412 172.928 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -117.41 175.48 3.25 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.132 0 C-N-CA 125.316 1.446 . . . . 10.0 110.581 175.601 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 70.79 -45.04 0.6 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.078 1.751 . . . . 10.0 112.035 -174.868 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -44.0 -37.59 3.05 Favored 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 119.503 1.047 . . . . 10.0 111.928 -177.424 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -81.03 -43.6 19.3 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 125.677 1.591 . . . . 10.0 112.227 -179.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -59.81 -31.7 47.97 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 CA-C-O 121.545 0.688 . . . . 10.0 110.09 175.68 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mmpt? -60.64 -51.06 70.98 Favored 'General case' 0 CA--C 1.544 0.716 0 O-C-N 121.579 -0.701 . . . . 10.0 112.284 169.871 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 54.1 m -62.28 -35.8 80.13 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 121.128 -0.983 . . . . 10.0 110.296 178.322 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 22.6 t -61.77 -54.8 29.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 C-N-CA 123.246 0.618 . . . . 10.0 111.294 177.413 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.72 -36.28 67.06 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 111.928 0.344 . . . . 10.0 111.928 177.059 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 50.0 m -72.37 -40.9 66.95 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.29 0.636 . . . . 10.0 112.566 178.26 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 85.32 114.86 0.77 Allowed Glycine 0 CA--C 1.528 0.861 0 N-CA-C 111.048 -0.821 . . . . 10.0 111.048 -168.103 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.91 -163.68 0.11 Allowed 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 123.436 0.695 . . . . 10.0 110.374 169.199 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 6.1 m-80 -71.06 -62.58 1.34 Allowed 'General case' 0 N--CA 1.471 0.584 0 O-C-N 119.839 -1.788 . . . . 10.0 111.353 -172.445 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -75.74 -14.93 60.34 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.894 1.278 . . . . 10.0 112.586 173.717 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.8 ttp -102.69 120.79 51.73 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 123.181 0.592 . . . . 10.0 112.134 -172.582 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -66.33 155.26 70.85 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 122.079 1.852 . . . . 10.0 112.128 -173.183 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -57.94 130.21 37.14 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 123.373 2.715 . . . . 10.0 110.461 -179.982 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 66.53 29.83 75.44 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 118.458 -1.19 . . . . 10.0 113.968 -172.4 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 46.4 29.3 3.75 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-N 118.984 1.392 . . . . 10.0 115.688 168.703 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 2.1 ttt 62.5 35.41 14.64 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 126.271 1.828 . . . . 10.0 114.195 -173.5 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 4.7 t -123.91 70.02 1.07 Allowed 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 126.763 2.025 . . . . 10.0 109.427 -178.28 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 72.7 p 11.55 -96.42 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 128.82 2.848 . . . . 10.0 115.675 -178.826 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -125.7 54.87 1.47 Allowed 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.913 1.285 . . . . 10.0 109.475 173.541 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 84.1 m -69.67 134.99 49.33 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.337 -0.852 . . . . 10.0 112.503 -178.655 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -99.59 140.39 33.86 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 124.622 1.169 . . . . 10.0 110.069 -178.184 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -39.27 -37.11 0.39 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 126.666 1.986 . . . . 10.0 113.496 176.711 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -36.39 -59.74 0.62 Allowed 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 125.549 1.54 . . . . 10.0 113.539 166.147 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -97.59 -25.43 15.14 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 123.581 0.752 . . . . 10.0 110.992 179.762 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.14 -54.18 48.96 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 120.826 -1.171 . . . . 10.0 110.612 176.276 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 11.2 pttp -61.83 -40.63 95.97 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 123.967 0.907 . . . . 10.0 110.219 -176.426 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -57.89 -30.75 66.12 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 121.949 -0.47 . . . . 10.0 111.735 171.007 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -78.77 -40.25 33.74 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 120.781 -1.199 . . . . 10.0 110.526 -173.001 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.24 -43.03 78.99 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 C-N-CA 122.799 0.439 . . . . 10.0 111.055 172.801 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.37 -30.96 71.84 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 121.524 -0.735 . . . . 10.0 111.636 179.286 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -51.05 -48.23 61.58 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 121.873 -0.517 . . . . 10.0 112.241 171.454 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -64.51 -47.24 79.64 Favored 'General case' 0 CA--C 1.532 0.26 0 O-C-N 121.734 -0.604 . . . . 10.0 111.496 174.073 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 5.9 t -164.28 -78.18 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 120.28 -0.568 . . . . 10.0 111.72 175.98 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 7.3 pttt 163.09 45.03 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.659 2.784 . . . . 10.0 109.501 -176.624 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -152.45 -81.05 0.1 Allowed 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 114.528 1.307 . . . . 10.0 114.528 166.617 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.461 ' HG3' ' CH2' ' A' ' 31' ' ' TRP . 0.1 OUTLIER . . . . . 0 C--O 1.254 1.299 0 N-CA-C 117.347 2.351 . . . . 10.0 117.347 -165.816 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.828 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 109.47 -0.567 . . . . 10.0 109.47 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -162.01 123.23 2.69 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.532 0.733 . . . . 10.0 110.232 -173.28 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . 0.435 HD12 HG13 ' A' ' 6' ' ' ILE . 0.3 OUTLIER -74.77 72.56 2.03 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-O 122.598 1.189 . . . . 10.0 109.184 173.754 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -106.65 -26.74 11.21 Favored 'General case' 0 C--N 1.33 -0.244 0 C-N-CA 125.556 1.542 . . . . 10.0 111.443 179.422 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -143.62 115.11 8.08 Favored 'General case' 0 N--CA 1.444 -0.762 0 C-N-CA 123.666 0.786 . . . . 10.0 109.177 172.02 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.417 ' HB1' ' N ' ' A' ' 70' ' ' ALA . . . -43.87 -36.99 2.6 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 114.2 1.185 . . . . 10.0 114.2 167.997 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -54.49 -50.81 66.9 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 118.716 0.689 . . . . 10.0 110.468 170.533 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.74 -34.12 76.21 Favored 'General case' 0 N--CA 1.456 -0.159 0 O-C-N 121.878 -0.513 . . . . 10.0 110.173 -175.638 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.435 HG13 HD12 ' A' ' -1' ' ' LEU . 22.2 mm -66.23 -51.05 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.23 0 CA-C-O 118.041 -0.981 . . . . 10.0 110.113 176.42 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.405 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.2 OUTLIER -67.59 -40.11 84.79 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 117.353 -1.739 . . . . 10.0 111.115 -179.916 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -69.07 -22.54 64.01 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.362 1.465 . . . . 10.0 112.637 -176.424 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 8.9 tttp -97.11 -26.66 14.9 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.443 1.097 . . . . 10.0 113.572 170.863 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -103.26 -68.35 0.84 Allowed 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 124.954 1.302 . . . . 10.0 113.042 -175.599 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.405 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -76.65 41.99 0.28 Allowed 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 125.469 1.508 . . . . 10.0 110.837 -178.476 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.4 t -126.76 -0.38 6.71 Favored 'General case' 0 C--N 1.333 -0.117 0 C-N-CA 124.596 1.158 . . . . 10.0 113.52 -163.683 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 28.2 t -104.11 -53.14 7.38 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.462 0 C-N-CA 125.047 1.339 . . . . 10.0 108.573 -174.609 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.7 m -80.34 -65.8 0.96 Allowed 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.213 1.805 . . . . 10.0 110.192 176.333 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 11.5 m-70 -72.91 -15.75 61.57 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.648 1.179 . . . . 10.0 113.983 -164.425 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 7.1 t -69.57 -41.24 76.09 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.827 -0.545 . . . . 10.0 110.829 -178.139 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 3.6 tpt -117.66 -35.76 3.86 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.889 1.276 . . . . 10.0 112.893 -177.468 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.89 56.46 1.31 Allowed Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.199 1.38 . . . . 10.0 113.693 179.927 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 64.0 t -78.49 -55.17 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 O-C-N 121.769 -0.842 . . . . 10.0 112.763 -176.046 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -83.05 32.83 0.44 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.739 0.815 . . . . 10.0 111.339 -179.076 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 62.0 32.21 81.37 Favored Glycine 0 CA--C 1.533 1.192 0 C-N-CA 123.926 0.774 . . . . 10.0 111.859 -169.914 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -75.65 148.23 82.39 Favored Pre-proline 0 CA--C 1.543 0.677 0 C-N-CA 123.656 0.782 . . . . 10.0 111.794 179.798 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -71.58 155.04 59.78 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 124.624 3.549 . . . . 10.0 110.481 -179.175 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.3 mttm -79.5 136.63 36.96 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 121.753 -0.592 . . . . 10.0 111.183 -172.525 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.7 m -37.13 -35.84 0.12 Allowed 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.783 1.633 . . . . 10.0 114.67 169.742 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 28.4 p80 -131.81 117.44 18.55 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.374 1.07 . . . . 10.0 109.425 171.268 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.464 ' HB3' ' HB3' ' A' ' 30' ' ' ASP . 3.2 m-20 -153.33 162.46 41.26 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 106.593 -1.632 . . . . 10.0 106.593 170.858 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 86.9 m -110.43 -36.35 5.8 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 118.21 0.459 . . . . 10.0 111.642 168.552 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.86 -25.24 37.81 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 121.289 -0.882 . . . . 10.0 113.046 -175.797 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . 0.464 ' HB3' ' HB3' ' A' ' 27' ' ' ASN . 65.1 t0 -79.18 -31.48 43.89 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 125.983 1.713 . . . . 10.0 109.383 176.057 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.49 ' CH2' ' HG3' ' A' ' 78' ' ' LYS . 56.7 m95 -84.02 -34.76 24.23 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.813 1.245 . . . . 10.0 111.285 179.481 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -41.85 -58.99 2.8 Favored Pre-proline 0 CA--C 1.551 0.984 0 N-CA-C 114.415 1.265 . . . . 10.0 114.415 173.451 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -73.72 6.79 2.64 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.33 2.687 . . . . 10.0 114.065 -178.784 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.603 HH12 ' CGD' ' A' ' 90' ' ' HEC . 0.0 OUTLIER -104.74 -42.0 5.51 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.981 0.912 . . . . 10.0 108.67 169.659 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.89 22.1 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.801 0 N-CA-C 115.159 1.54 . . . . 10.0 115.159 164.73 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -90.18 -36.96 14.49 Favored 'General case' 0 CA--C 1.529 0.149 0 O-C-N 120.955 -1.091 . . . . 10.0 110.023 178.768 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 13.8 mttt -76.35 -54.94 6.04 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 116.435 -0.348 . . . . 10.0 110.977 174.005 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 136.37 50.76 0.07 OUTLIER Glycine 0 CA--C 1.534 1.261 0 CA-C-O 119.334 -0.703 . . . . 10.0 114.808 168.483 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 1.9 t 62.03 165.36 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 124.861 1.264 . . . . 10.0 111.906 -179.67 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 77.41 -50.96 0.54 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.417 1.487 . . . . 10.0 110.738 -179.929 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -38.23 -41.08 0.57 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.655 1.182 . . . . 10.0 111.942 172.091 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.408 ' HB3' ' CMA' ' A' ' 90' ' ' HEC . 1.3 mm? -68.37 -50.89 49.95 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 124.596 1.158 . . . . 10.0 111.293 -179.436 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.57 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.4 OUTLIER -50.45 -29.29 6.28 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.044 0 C-N-CA 124.321 1.049 . . . . 10.0 112.357 167.541 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.509 ' HE3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -81.67 -37.36 27.55 Favored 'General case' 0 CA--C 1.543 0.693 0 O-C-N 120.676 -1.265 . . . . 10.0 114.362 173.64 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.5 m -76.0 -16.9 59.89 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.451 1.1 . . . . 10.0 111.421 173.767 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.57 HG12 ' HA ' ' A' ' 43' ' ' VAL . 4.5 p -89.05 -41.23 13.82 Favored 'Isoleucine or valine' 0 C--N 1.34 0.167 0 O-C-N 121.666 -0.646 . . . . 10.0 111.801 175.119 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.411 ' HA ' ' HA2' ' A' ' 56' ' ' GLY . 0.0 OUTLIER -53.11 -39.3 63.32 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.91 0.862 . . . . 10.0 110.942 177.315 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 5.5 t -73.34 -39.1 65.48 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 125.277 1.431 . . . . 10.0 112.243 178.256 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 82.5 99.84 0.47 Allowed Glycine 0 CA--C 1.532 1.124 0 C-N-CA 123.36 0.505 . . . . 10.0 111.99 -174.961 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 10.6 tp -58.56 168.88 1.03 Allowed 'General case' 0 CA--C 1.54 0.59 0 O-C-N 121.947 -0.737 . . . . 10.0 111.693 170.026 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.474 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 10.9 m-80 -46.96 -57.96 4.45 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 125.531 1.532 . . . . 10.0 113.547 -174.336 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -87.69 14.77 7.87 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 114.367 -1.288 . . . . 10.0 112.538 177.138 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -110.96 153.51 43.78 Favored Pre-proline 0 CA--C 1.543 0.678 0 N-CA-C 114.795 1.406 . . . . 10.0 114.795 171.678 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -72.58 154.13 54.88 Favored 'Trans proline' 0 N--CA 1.454 -0.821 0 C-N-CA 122.564 2.176 . . . . 10.0 110.737 169.327 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -62.09 132.41 39.09 Favored 'Trans proline' 0 N--CA 1.456 -0.733 0 C-N-CA 122.641 2.227 . . . . 10.0 108.408 175.783 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.411 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 63.11 30.21 76.79 Favored Glycine 0 C--N 1.338 0.648 0 C-N-CA 118.946 -1.597 . . . . 10.0 112.357 179.697 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 44.57 32.28 2.8 Favored Glycine 0 CA--C 1.541 1.668 0 CA-C-N 118.076 0.938 . . . . 10.0 113.987 -179.121 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 1.1 ttt 70.19 44.42 0.76 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 126.019 1.728 . . . . 10.0 113.224 -176.438 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.07 156.32 40.17 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 124.99 1.316 . . . . 10.0 111.572 178.555 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 49.0 m -112.16 -91.97 0.48 Allowed 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 124.275 1.03 . . . . 10.0 109.74 -179.257 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.8 m-20 -89.8 66.53 7.06 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.875 1.27 . . . . 10.0 109.52 178.625 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 62.7 m -117.96 127.24 53.64 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.558 1.143 . . . . 10.0 111.429 -176.126 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 85.6 m -122.57 146.14 47.7 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 123.75 0.82 . . . . 10.0 109.927 -173.129 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -37.26 -42.45 0.46 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 126.983 2.113 . . . . 10.0 113.43 -178.406 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -35.87 -53.2 0.74 Allowed 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 125.263 1.425 . . . . 10.0 113.905 172.296 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -100.56 -33.51 10.29 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.741 0.816 . . . . 10.0 111.655 173.823 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.04 -40.13 57.53 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.616 -1.302 . . . . 10.0 112.043 177.981 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 18.2 pttt -69.1 -48.25 63.09 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 123.387 0.675 . . . . 10.0 109.972 178.053 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -55.25 -32.34 62.25 Favored 'General case' 0 CA--C 1.539 0.555 0 CA-C-N 118.374 0.534 . . . . 10.0 111.802 175.102 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.417 ' N ' ' HB1' ' A' ' 3' ' ' ALA . . . -67.54 -42.45 82.68 Favored 'General case' 0 N--CA 1.466 0.369 0 C-N-CA 123.985 0.914 . . . . 10.0 109.934 -178.76 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -67.92 -51.83 45.66 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 C-N-CA 125.999 1.72 . . . . 10.0 111.773 173.193 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -58.81 -32.7 69.6 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 125.236 1.415 . . . . 10.0 111.966 178.057 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -47.3 -50.46 21.59 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.275 0.488 . . . . 10.0 111.845 175.987 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.459 ' CB ' ' CH2' ' A' ' 31' ' ' TRP . 5.2 mpp? -66.73 -45.71 77.79 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 111.966 0.358 . . . . 10.0 111.966 179.002 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 25.2 t -162.59 -71.48 0.05 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 123.015 0.526 . . . . 10.0 111.567 176.712 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.2 pttt 160.43 50.11 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 128.38 2.672 . . . . 10.0 110.972 -175.097 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.1 -80.95 0.05 OUTLIER 'General case' 0 C--O 1.224 -0.282 0 O-C-N 121.271 -0.893 . . . . 10.0 113.043 171.711 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.49 ' HG3' ' CH2' ' A' ' 31' ' ' TRP . 6.4 ptpp? . . . . . 0 C--O 1.251 1.158 0 N-CA-C 114.832 1.419 . . . . 10.0 114.832 -178.584 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.864 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 117.952 -1.023 . . . . 10.0 109.355 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -159.53 127.75 4.98 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.659 0.663 . . . . 10.0 109.797 -155.666 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . 0.47 ' HA ' HD11 ' A' ' 6' ' ' ILE . 0.5 OUTLIER -74.03 72.04 1.63 Allowed 'General case' 0 CA--C 1.54 0.589 0 CA-C-O 122.27 1.033 . . . . 10.0 110.303 179.731 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -112.64 -21.58 11.19 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.194 1.798 . . . . 10.0 114.313 178.276 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.425 ' C ' HD13 ' A' ' 6' ' ' ILE . 23.1 t70 -134.81 -129.49 0.16 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.591 1.556 . . . . 10.0 111.28 -167.518 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.7 -52.2 0.15 Allowed 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 129.977 3.311 . . . . 10.0 109.112 -173.77 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -57.67 -49.28 77.02 Favored 'General case' 0 C--N 1.343 0.3 0 CA-C-O 121.441 0.639 . . . . 10.0 110.154 174.35 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.61 -30.9 70.61 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.902 -0.499 . . . . 10.0 110.775 -176.11 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.47 HD11 ' HA ' ' A' ' -1' ' ' LEU . 1.7 mp -67.95 -51.5 48.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 N-CA-C 108.678 -0.86 . . . . 10.0 108.678 -179.835 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -68.36 -42.84 78.62 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 119.625 -0.83 . . . . 10.0 110.837 178.811 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -67.35 -22.4 65.59 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 125.002 1.321 . . . . 10.0 111.94 -176.13 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.77 -30.81 16.81 Favored 'General case' 0 CA--C 1.548 0.881 0 N-CA-C 114.015 1.117 . . . . 10.0 114.015 167.303 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.03 -65.64 1.14 Allowed 'General case' 0 N--CA 1.474 0.77 0 CA-C-N 119.893 1.224 . . . . 10.0 113.147 -171.094 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.28 43.83 0.31 Allowed 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 125.146 1.378 . . . . 10.0 110.175 178.412 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.9 t -124.63 -3.25 7.82 Favored 'General case' 0 CA--C 1.519 -0.224 0 C-N-CA 125.076 1.35 . . . . 10.0 113.803 -166.254 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 21.4 t -103.2 -48.11 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 124.312 1.045 . . . . 10.0 108.554 -174.268 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.4 m -85.09 -66.28 0.91 Allowed 'General case' 0 N--CA 1.45 -0.464 0 C-N-CA 125.748 1.619 . . . . 10.0 110.757 174.157 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.9 m-70 -73.87 -19.37 60.74 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.824 1.416 . . . . 10.0 114.824 -163.22 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 40.2 t -64.79 -54.83 25.02 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.038 0.535 . . . . 10.0 111.035 175.543 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 2.7 tpt -97.0 -20.16 18.26 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.725 0.81 . . . . 10.0 112.747 -177.841 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.58 42.67 6.4 Favored Glycine 0 CA--C 1.536 1.359 0 C-N-CA 125.563 1.554 . . . . 10.0 112.3 -173.665 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 15.3 t -81.01 159.28 4.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 O-C-N 121.693 -0.886 . . . . 10.0 109.146 176.505 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.53 19.84 5.65 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.914 1.286 . . . . 10.0 113.37 -174.939 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.6 24.35 76.34 Favored Glycine 0 CA--C 1.533 1.176 0 C-N-CA 123.906 0.765 . . . . 10.0 113.127 -173.476 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.43 145.32 87.67 Favored Pre-proline 0 CA--C 1.541 0.61 0 CA-C-N 118.596 1.198 . . . . 10.0 113.533 -177.782 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.473 ' HD3' HBD2 ' A' ' 90' ' ' HEC . 86.5 Cg_endo -75.17 145.9 31.41 Favored 'Trans proline' 0 N--CA 1.454 -0.828 1 C-N-CA 125.512 4.142 . . . . 10.0 109.825 -179.993 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -66.77 152.41 45.56 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-O 122.354 1.073 . . . . 10.0 112.137 -167.048 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.6 p -49.26 -33.18 12.27 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.721 1.608 . . . . 10.0 112.592 167.426 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -142.1 74.14 1.44 Allowed 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 125.151 1.38 . . . . 10.0 111.947 -177.335 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 15.5 m-20 -103.41 166.27 10.53 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.767 1.227 . . . . 10.0 108.927 166.928 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 12.5 t -110.19 -36.03 5.94 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 111.948 0.351 . . . . 10.0 111.948 166.979 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -79.87 -23.92 41.57 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.654 -1.279 . . . . 10.0 112.535 -176.86 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -79.21 -29.79 42.98 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.165 1.386 . . . . 10.0 110.509 178.455 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.465 ' HE3' ' HB3' ' A' ' 77' ' ' ALA . 57.7 m95 -89.64 -38.59 13.8 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 126.322 1.849 . . . . 10.0 111.091 -179.495 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -39.43 -61.97 0.9 Allowed Pre-proline 0 CA--C 1.548 0.872 0 N-CA-C 114.709 1.374 . . . . 10.0 114.709 174.961 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -70.04 -1.82 9.35 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 123.353 2.702 . . . . 10.0 113.862 -177.572 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 56.1 mmt-85 -98.9 -47.31 5.32 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 125.486 1.514 . . . . 10.0 108.695 176.665 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.15 -10.16 4.12 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 126.227 1.811 . . . . 10.0 113.656 172.762 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -75.81 -27.74 58.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.17 1.388 . . . . 10.0 109.503 178.179 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -92.96 -56.87 2.83 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.856 0.463 . . . . 10.0 110.51 169.412 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.487 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 165.47 -122.39 1.07 Allowed Glycine 0 CA--C 1.529 0.928 0 N-CA-C 111.567 -0.613 . . . . 10.0 111.567 179.864 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 8.3 p -151.4 -56.42 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.438 0 CA-C-N 117.719 0.759 . . . . 10.0 111.352 -178.777 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.07 1.78 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.858 0 N-CA-C 114.999 1.481 . . . . 10.0 114.999 171.748 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.487 HD21 ' N ' ' A' ' 38' ' ' GLY . 1.9 m-80 -69.7 -59.39 2.98 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.085 -1.009 . . . . 10.0 109.806 164.824 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.56 ' HB3' HMA2 ' A' ' 90' ' ' HEC . 2.9 mp -80.09 -20.89 44.05 Favored 'General case' 0 CA--C 1.532 0.255 0 O-C-N 121.38 -0.825 . . . . 10.0 111.042 -166.436 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.437 ' HA ' HG12 ' A' ' 46' ' ' VAL . 0.4 OUTLIER -59.13 -15.68 7.59 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.687 0 C-N-CA 124.285 1.034 . . . . 10.0 112.452 164.005 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -82.57 -35.21 27.36 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 121.086 -1.009 . . . . 10.0 111.819 168.15 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 7.8 t -69.69 -44.77 69.73 Favored 'General case' 0 N--CA 1.464 0.252 0 C-N-CA 123.481 0.713 . . . . 10.0 110.277 177.663 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.437 HG12 ' HA ' ' A' ' 43' ' ' VAL . 3.6 p -58.58 -41.61 82.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 123.24 0.616 . . . . 10.0 111.632 -179.148 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.407 ' NZ ' ' OD1' ' A' ' 64' ' ' ASP . 0.0 OUTLIER -70.88 -28.51 64.61 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.966 -0.459 . . . . 10.0 111.781 179.505 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.3 m -76.23 -35.09 59.18 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 124.865 1.266 . . . . 10.0 112.507 172.656 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 80.72 105.05 0.3 Allowed Glycine 0 CA--C 1.525 0.684 0 C-N-CA 123.727 0.679 . . . . 10.0 111.873 -170.345 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.4 tp -68.07 174.51 3.77 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 122.095 -0.65 . . . . 10.0 110.252 170.338 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.488 ' ND2' ' H ' ' A' ' 51' ' ' ASN . 15.3 m-80 -49.57 -54.75 16.44 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 120.598 -1.314 . . . . 10.0 113.138 -172.67 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -88.78 16.02 7.44 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.398 1.479 . . . . 10.0 112.95 175.76 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -122.98 142.96 39.42 Favored Pre-proline 0 CA--C 1.545 0.784 0 N-CA-C 115.024 1.49 . . . . 10.0 115.024 175.955 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.64 139.92 41.86 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 121.885 1.723 . . . . 10.0 110.835 177.171 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_endo -60.95 119.91 7.33 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.938 2.425 . . . . 10.0 109.582 177.187 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.402 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 86.93 12.65 68.08 Favored Glycine 0 CA--C 1.528 0.884 0 C-N-CA 119.625 -1.274 . . . . 10.0 112.643 -175.343 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 60.29 14.6 34.24 Favored Glycine 0 CA--C 1.54 1.614 0 CA-C-N 119.478 1.639 . . . . 10.0 114.579 171.415 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.4 ttt 41.82 45.62 3.18 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.445 2.298 . . . . 10.0 114.525 -175.357 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 1.8 p -115.56 24.86 11.23 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.628 1.171 . . . . 10.0 113.388 178.63 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.6 m 65.0 -127.97 0.35 Allowed 'General case' 0 CA--C 1.546 0.822 0 C-N-CA 123.699 0.8 . . . . 10.0 110.422 177.087 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -79.29 60.0 2.98 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 124.826 1.25 . . . . 10.0 110.999 -179.304 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 2.8 m -60.9 96.34 0.05 OUTLIER 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 123.995 0.918 . . . . 10.0 112.076 -177.452 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.3 t -88.46 129.66 35.38 Favored 'General case' 0 C--N 1.34 0.159 0 O-C-N 121.072 -1.017 . . . . 10.0 108.386 176.672 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.407 ' OD1' ' NZ ' ' A' ' 47' ' ' LYS . 5.8 m-20 -38.83 -38.5 0.43 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.979 1.712 . . . . 10.0 113.137 178.514 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -43.4 -59.44 2.13 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.264 1.425 . . . . 10.0 112.23 169.183 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 66.4 m-20 -80.7 -37.4 30.73 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.965 0.888 . . . . 10.0 110.344 -179.231 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -54.6 -46.88 73.89 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.394 1.078 . . . . 10.0 111.161 -179.3 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 36.8 pttt -72.77 -47.61 45.25 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 124.386 1.074 . . . . 10.0 108.869 -179.639 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -47.63 -41.1 21.27 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.73 0.412 . . . . 10.0 111.791 173.727 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.76 -53.78 53.16 Favored 'General case' 0 C--O 1.223 -0.334 0 C-N-CA 123.224 0.609 . . . . 10.0 111.237 179.758 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 31.7 pt -71.65 -31.5 42.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 O-C-N 120.961 -1.087 . . . . 10.0 112.84 179.579 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -58.24 -40.45 81.77 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 123.409 0.684 . . . . 10.0 111.352 167.478 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 29.6 t80 -51.82 -43.76 63.25 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.508 0.559 . . . . 10.0 112.508 177.165 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.64 -70.37 0.27 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 111.909 0.337 . . . . 10.0 111.909 179.485 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 6.2 t -162.45 31.56 0.11 Allowed 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.833 0.679 . . . . 10.0 112.833 -178.973 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 6.4 ptpt 35.58 51.1 0.64 Allowed 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 115.624 1.713 . . . . 10.0 115.624 178.786 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.465 ' HB3' ' HE3' ' A' ' 31' ' ' TRP . . . -132.17 -49.82 0.94 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 113.629 0.974 . . . . 10.0 113.629 -176.092 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.9 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 12.7 pttp . . . . . 0 C--O 1.249 1.049 0 CA-C-O 116.606 -1.664 . . . . 10.0 112.08 -177.266 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.9 HMA3 ' HB2' ' A' ' 78' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 110.168 -0.308 . . . . 10.0 110.168 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -161.06 119.95 2.53 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.524 0.73 . . . . 10.0 110.158 -169.45 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -75.13 65.27 1.49 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 123.386 0.674 . . . . 10.0 109.722 176.193 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -111.75 -27.71 8.39 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.4 1.48 . . . . 10.0 112.759 176.54 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -152.0 114.58 4.58 Favored 'General case' 0 N--CA 1.447 -0.605 0 CA-C-O 121.951 0.882 . . . . 10.0 109.32 174.98 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.481 ' HB1' ' N ' ' A' ' 70' ' ' ALA . . . -56.25 -28.25 57.86 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 114.212 1.19 . . . . 10.0 114.212 174.31 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 50.0 tt0 -56.24 -48.33 76.72 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 119.093 0.86 . . . . 10.0 110.426 166.812 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 -34.55 76.48 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.792 -0.568 . . . . 10.0 110.176 -178.019 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 18.2 mm -65.49 -51.17 66.8 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 CA-C-O 118.871 -0.585 . . . . 10.0 109.668 176.939 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.454 ' HA ' ' SG ' ' A' ' 11' ' ' CYS . 0.1 OUTLIER -68.11 -41.1 82.29 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 118.176 -1.41 . . . . 10.0 111.014 -178.899 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -69.05 -22.28 64.04 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.363 1.465 . . . . 10.0 112.755 -178.06 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.45 -29.07 16.45 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.31 1.044 . . . . 10.0 113.554 168.559 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -110.3 -65.08 1.19 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.806 1.185 . . . . 10.0 112.952 -172.192 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.454 ' SG ' ' HA ' ' A' ' 7' ' ' TYR . 0.0 OUTLIER -74.46 39.74 0.13 Allowed 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 125.542 1.537 . . . . 10.0 111.322 178.655 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 12.7 t -126.71 3.34 6.74 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 125.084 1.353 . . . . 10.0 113.676 -165.16 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 24.3 t -100.91 -38.72 6.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 C-N-CA 124.604 1.162 . . . . 10.0 108.685 -177.355 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 35.3 m -110.28 -58.73 2.03 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 126.263 1.825 . . . . 10.0 109.65 -170.275 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 26.3 m-70 -73.48 -25.7 60.58 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 113.289 0.848 . . . . 10.0 113.289 -173.394 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.18 -51.27 64.9 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 123.903 0.881 . . . . 10.0 110.499 -177.393 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -111.44 -23.29 10.84 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.771 1.228 . . . . 10.0 112.358 -177.878 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.83 59.96 1.16 Allowed Glycine 0 CA--C 1.537 1.44 0 C-N-CA 124.381 0.991 . . . . 10.0 112.518 -175.513 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 25.6 t -104.74 159.65 5.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 C-N-CA 125.515 1.526 . . . . 10.0 109.638 178.237 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 58.54 23.08 10.41 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.441 1.096 . . . . 10.0 113.178 -176.08 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 77.24 10.06 86.46 Favored Glycine 0 CA--C 1.536 1.377 0 C-N-CA 124.304 0.954 . . . . 10.0 113.468 -174.441 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.51 149.62 98.26 Favored Pre-proline 0 CA--C 1.543 0.684 0 CA-C-N 118.622 1.211 . . . . 10.0 111.451 179.087 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -76.41 163.94 31.5 Favored 'Trans proline' 0 N--CA 1.457 -0.653 0 C-N-CA 123.859 3.039 . . . . 10.0 110.09 -177.398 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -71.31 141.04 50.49 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.589 -0.694 . . . . 10.0 111.776 -178.087 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.7 t -35.63 -37.79 0.1 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 127.233 2.213 . . . . 10.0 114.327 171.444 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 40.4 p-80 -139.57 118.43 12.46 Favored 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 108.106 -1.072 . . . . 10.0 108.106 168.812 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -138.19 161.2 37.45 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 107.299 -1.371 . . . . 10.0 107.299 168.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.7 t -106.55 -33.24 7.74 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 117.514 0.143 . . . . 10.0 111.255 169.335 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -71.84 -36.1 70.07 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 120.412 -1.43 . . . . 10.0 113.485 -179.941 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -80.54 -21.87 41.39 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 123.033 0.533 . . . . 10.0 110.908 -178.314 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 62.9 m95 -93.87 -34.88 12.96 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.659 1.583 . . . . 10.0 109.945 -178.21 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mm-40 -41.39 -63.02 0.89 Allowed Pre-proline 0 CA--C 1.546 0.792 0 C-N-CA 124.786 1.234 . . . . 10.0 114.296 175.003 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -73.24 5.42 3.15 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.86 2.373 . . . . 10.0 113.975 -178.224 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? -106.37 -44.08 4.61 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 126.476 1.91 . . . . 10.0 109.463 174.081 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -72.25 12.21 0.47 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.755 2.022 . . . . 10.0 113.191 173.764 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -83.94 -27.69 28.35 Favored 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 125.124 1.369 . . . . 10.0 109.914 177.649 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 6.2 mptt -90.93 -56.78 3.05 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.142 0.577 . . . . 10.0 110.831 175.218 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 150.32 -124.78 1.81 Allowed Glycine 0 CA--C 1.528 0.862 0 N-CA-C 110.949 -0.86 . . . . 10.0 110.949 175.748 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -126.23 177.55 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 C-N-CA 125.528 1.531 . . . . 10.0 110.041 176.335 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.49 ' HA ' HG12 ' A' ' 43' ' ' VAL . 7.6 t70 73.8 -43.55 0.55 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 124.779 1.231 . . . . 10.0 111.614 -171.249 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.32 -48.7 65.28 Favored 'General case' 0 N--CA 1.469 0.485 0 O-C-N 120.691 -1.256 . . . . 10.0 112.537 -174.028 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.7 mt -88.54 -37.67 15.53 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.603 1.161 . . . . 10.0 111.011 -173.513 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.49 HG12 ' HA ' ' A' ' 40' ' ' ASP . 0.3 OUTLIER -58.26 -29.19 36.96 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 CA-C-O 121.426 0.631 . . . . 10.0 110.382 171.699 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.4 mtpt -63.86 -52.48 59.85 Favored 'General case' 0 N--CA 1.448 -0.547 0 O-C-N 120.395 -1.441 . . . . 10.0 114.243 168.884 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.23 -33.12 70.62 Favored 'General case' 0 N--CA 1.465 0.293 0 O-C-N 121.155 -0.966 . . . . 10.0 109.872 -179.846 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.54 -42.03 83.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 115.352 -0.84 . . . . 10.0 111.985 174.954 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.437 ' HA ' ' HA2' ' A' ' 56' ' ' GLY . 0.1 OUTLIER -81.82 -25.54 35.08 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.446 0.641 . . . . 10.0 111.71 -177.776 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 54.9 m -73.55 -32.98 64.47 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.944 0.897 . . . . 10.0 112.312 174.03 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 89.54 124.19 2.51 Favored Glycine 0 C--N 1.343 0.923 0 CA-C-N 119.755 1.161 . . . . 10.0 111.634 -174.194 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.43 -157.54 0.79 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.139 0.976 . . . . 10.0 111.91 176.155 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.2 m120 -68.03 138.48 55.88 Favored 'General case' 0 CA--C 1.496 -1.114 0 CA-C-O 122.524 1.154 . . . . 10.0 109.508 -179.311 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.449 ' HB3' HMD2 ' A' ' 90' ' ' HEC . . . 56.29 18.86 3.58 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 111.516 -2.584 . . . . 10.0 112.003 176.459 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 2.0 ttp -136.89 121.64 12.64 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 123.993 0.917 . . . . 10.0 111.265 -171.733 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo -68.36 143.89 59.84 Favored 'Trans proline' 0 CA--C 1.54 0.779 0 C-N-CA 121.602 1.535 . . . . 10.0 111.632 -174.971 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -62.16 113.95 2.11 Favored 'Trans proline' 0 N--CA 1.453 -0.853 0 C-N-CA 123.43 2.753 . . . . 10.0 109.618 178.685 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.437 ' HA2' ' HA ' ' A' ' 47' ' ' LYS . . . 104.84 20.62 9.76 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 123.488 0.493 . . . . 10.0 112.75 -175.502 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 51.39 34.45 33.97 Favored Glycine 0 CA--C 1.54 1.605 0 CA-C-N 119.286 1.543 . . . . 10.0 114.116 177.434 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.0 ttt 65.16 23.12 12.31 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 126.15 1.78 . . . . 10.0 113.222 -176.554 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 14.3 t -121.91 155.61 35.1 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.725 1.21 . . . . 10.0 112.06 -170.732 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 80.2 m -88.49 -66.38 0.92 Allowed 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 123.646 0.779 . . . . 10.0 111.139 179.736 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -124.46 63.78 1.1 Allowed 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.403 1.081 . . . . 10.0 109.416 -177.747 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 3.0 m -81.54 118.89 23.12 Favored 'General case' 0 N--CA 1.464 0.25 0 O-C-N 121.686 -0.634 . . . . 10.0 110.45 172.01 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 62.2 m -108.28 135.44 49.6 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 108.345 -0.983 . . . . 10.0 108.345 179.707 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -32.38 -46.09 0.12 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 126.722 2.009 . . . . 10.0 114.477 -179.719 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -28.35 -60.85 0.12 Allowed 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 126.682 1.993 . . . . 10.0 113.324 167.779 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -93.18 -37.14 12.26 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 123.937 0.895 . . . . 10.0 111.988 173.127 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.67 -39.07 50.03 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.985 -1.072 . . . . 10.0 112.311 -177.373 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 9.7 ptmt -75.51 -50.62 15.14 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 124.746 1.219 . . . . 10.0 109.361 178.671 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -50.87 -30.81 15.5 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 123.575 0.75 . . . . 10.0 111.955 179.174 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.481 ' N ' ' HB1' ' A' ' 3' ' ' ALA . . . -63.05 -44.85 94.69 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.546 0.738 . . . . 10.0 111.663 175.257 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 19.0 mt -73.18 -41.22 58.5 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.681 0 C-N-CA 126.681 1.992 . . . . 10.0 111.086 177.425 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -63.83 -33.79 76.47 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.583 1.153 . . . . 10.0 111.862 174.836 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -55.13 -34.36 63.66 Favored 'General case' 0 CA--C 1.543 0.707 0 N-CA-C 112.496 0.554 . . . . 10.0 112.496 171.282 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 65.6 mtm -86.43 -72.48 0.5 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.709 0.804 . . . . 10.0 112.229 -178.839 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -158.34 34.16 0.24 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 112.515 0.561 . . . . 10.0 112.515 178.064 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 2.1 ptmt 42.68 52.28 4.96 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 125.748 1.619 . . . . 10.0 113.86 172.237 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -158.94 -81.73 0.05 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.481 1.112 . . . . 10.0 112.656 173.233 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.456 ' HA ' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.229 0 N-CA-C 115.66 1.726 . . . . 10.0 115.66 -171.058 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.787 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' -3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.236 0 CA-C-O 119.552 -0.261 . . . . 10.0 111.524 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' -2' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -166.35 128.52 1.86 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-O 119.228 -0.415 . . . . 10.0 111.412 -169.42 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' -1' ' ' LEU . . . . . . . . . . . . 0.254 0.0 OUTLIER -77.6 61.53 2.35 Favored 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 122.631 1.205 . . . . 10.0 111.183 178.554 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -109.91 -20.22 12.83 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 113.468 0.914 . . . . 10.0 113.468 -178.857 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -146.05 -175.79 4.9 Favored 'General case' 0 N--CA 1.443 -0.781 0 N-CA-C 105.437 -2.06 . . . . 10.0 105.437 177.04 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.545 ' HB2' ' HB3' ' A' ' 69' ' ' ALA . . . -93.58 -44.32 8.26 Favored 'General case' 0 N--CA 1.441 -0.903 0 C-N-CA 126.215 1.806 . . . . 10.0 112.941 169.023 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -54.41 -37.74 65.42 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-O 121.528 0.68 . . . . 10.0 110.163 -177.451 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -78.94 -28.96 43.79 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 123.905 0.882 . . . . 10.0 113.087 174.802 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.28 -51.39 43.4 Favored 'Isoleucine or valine' 0 C--N 1.339 0.126 0 N-CA-C 109.23 -0.656 . . . . 10.0 109.23 179.629 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -68.05 -29.46 68.44 Favored 'General case' 0 CA--C 1.536 0.431 0 O-C-N 121.363 -0.836 . . . . 10.0 111.035 -176.36 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -67.11 -23.29 65.82 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 126.072 1.749 . . . . 10.0 114.069 174.063 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 10.9 tppt? -100.66 -27.89 13.14 Favored 'General case' 0 CA--C 1.539 0.551 0 N-CA-C 113.357 0.873 . . . . 10.0 113.357 172.174 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -107.99 -72.3 0.73 Allowed 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 124.988 1.315 . . . . 10.0 110.978 -167.068 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -75.74 37.3 0.14 Allowed 'General case' 0 CA--C 1.556 1.174 0 C-N-CA 124.731 1.212 . . . . 10.0 110.667 179.043 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.0 t -120.53 -1.99 10.03 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 126.023 1.729 . . . . 10.0 114.041 -169.949 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 17.3 t -100.87 -39.89 7.41 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-O 122.362 1.077 . . . . 10.0 108.491 -174.275 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 71.0 m -101.09 -63.53 1.13 Allowed 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 128.003 2.521 . . . . 10.0 110.352 -177.709 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 66.4 m-70 -74.06 -29.15 61.75 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 114.483 1.29 . . . . 10.0 114.483 -168.693 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.1 m -54.8 -47.26 74.22 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.655 0.782 . . . . 10.0 110.881 178.59 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 1.4 ttt -116.26 -10.7 11.38 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.035 0.934 . . . . 10.0 112.526 -174.135 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.32 48.31 6.91 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 123.854 0.74 . . . . 10.0 112.85 -178.491 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 86.7 t -88.11 158.14 3.08 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 C-N-CA 125.438 1.495 . . . . 10.0 109.055 176.936 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . 57.84 22.49 8.65 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 113.697 0.999 . . . . 10.0 113.697 -175.204 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 72.3 8.37 70.24 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 123.694 0.664 . . . . 10.0 113.332 -172.629 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.16 142.47 85.86 Favored Pre-proline 0 CA--C 1.537 0.445 0 CA-C-N 118.26 1.03 . . . . 10.0 111.713 -178.638 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.448 ' HB2' ' HE2' ' A' ' 78' ' ' LYS . 83.4 Cg_endo -73.59 150.08 44.92 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.879 2.386 . . . . 10.0 111.092 -179.329 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.62 151.36 13.89 Favored 'General case' 0 C--O 1.245 0.851 0 CA-C-O 122.455 1.121 . . . . 10.0 112.482 -174.293 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 12.0 p -56.35 -34.35 66.53 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 128.104 2.562 . . . . 10.0 112.945 173.795 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 8.3 p80 -141.05 51.48 1.6 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-O 121.8 0.809 . . . . 10.0 112.41 177.275 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -69.64 161.62 29.31 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.133 -0.98 . . . . 10.0 109.948 170.592 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 14.4 t -107.86 -32.79 7.46 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 121.874 -0.516 . . . . 10.0 111.543 165.115 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.36 -24.78 39.57 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 120.42 -1.425 . . . . 10.0 113.587 -177.34 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -82.66 -18.98 39.12 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.745 1.618 . . . . 10.0 111.6 175.498 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 60.2 m95 -103.52 -34.19 8.76 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.744 1.618 . . . . 10.0 110.736 -176.853 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -43.29 -57.4 5.41 Favored Pre-proline 0 CA--C 1.545 0.786 0 CA-C-N 119.462 1.028 . . . . 10.0 113.637 170.991 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.12 3.53 3.94 Favored 'Trans proline' 0 CA--C 1.539 0.768 0 C-N-CA 122.187 1.925 . . . . 10.0 113.52 -179.308 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.568 ' HB2' ' HB1' ' A' ' 77' ' ' ALA . 8.0 mmt85 -104.74 -47.89 3.93 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 125.765 1.626 . . . . 10.0 108.728 178.374 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.489 ' HG ' ' HB2' ' A' ' 77' ' ' ALA . 0.6 OUTLIER -57.0 0.16 0.04 OUTLIER 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.38 2.272 . . . . 10.0 114.246 168.122 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -87.69 -22.28 24.74 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 124.808 1.243 . . . . 10.0 110.484 175.678 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 17.9 mtmm -106.16 -63.45 1.26 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 123.565 0.746 . . . . 10.0 111.056 174.37 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.476 ' N ' HD21 ' A' ' 41' ' ' ASN . . . 156.95 -165.31 33.12 Favored Glycine 0 CA--C 1.53 0.978 0 N-CA-C 111.363 -0.695 . . . . 10.0 111.363 -176.254 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -100.87 -41.77 9.12 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 124.329 1.052 . . . . 10.0 111.739 178.671 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.49 10.42 0.06 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 126.819 2.048 . . . . 10.0 114.694 -177.028 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.476 HD21 ' N ' ' A' ' 38' ' ' GLY . 0.1 OUTLIER -105.9 -58.06 1.96 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 126.192 1.797 . . . . 10.0 107.099 178.331 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.5 mt -72.46 -30.67 64.78 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.022 -0.99 . . . . 10.0 109.847 -174.392 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 3.0 p -60.99 -33.23 54.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.78 0 CA-C-O 121.745 0.783 . . . . 10.0 110.879 171.863 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.6 mmtt -69.73 -41.74 74.9 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 121.236 -0.915 . . . . 10.0 110.609 177.696 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.1 m -63.15 -36.0 82.16 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 121.458 -0.776 . . . . 10.0 110.317 174.294 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 4.5 t -60.52 -51.05 77.55 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 121.145 0.497 . . . . 10.0 111.647 179.375 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.14 -33.61 72.39 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.078 0.466 . . . . 10.0 112.256 176.657 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 17.1 m -73.38 -33.07 64.84 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.822 0.849 . . . . 10.0 112.048 179.535 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 77.28 114.82 0.16 Allowed Glycine 0 CA--C 1.528 0.89 0 N-CA-C 111.195 -0.762 . . . . 10.0 111.195 -169.479 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -69.28 -157.33 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 124.145 0.978 . . . . 10.0 110.563 167.873 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -72.24 -63.35 1.16 Allowed 'General case' 0 N--CA 1.476 0.848 0 O-C-N 119.367 -2.083 . . . . 10.0 111.388 -175.167 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -74.72 -19.43 60.24 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.961 1.305 . . . . 10.0 111.742 176.608 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' MET . . . . . . . . . . . . . 6.1 ttp -97.43 120.35 61.03 Favored Pre-proline 0 CA--C 1.541 0.606 0 C-N-CA 123.405 0.682 . . . . 10.0 111.757 -173.216 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -69.42 155.69 66.35 Favored 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 121.715 1.61 . . . . 10.0 111.941 -173.273 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 40.2 Cg_endo -63.95 117.82 4.8 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.997 2.465 . . . . 10.0 109.515 -177.564 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 93.08 30.48 9.32 Favored Glycine 0 CA--C 1.533 1.167 0 C-N-CA 120.997 -0.62 . . . . 10.0 112.78 -175.201 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 66.74 -63.53 0.18 Allowed Glycine 0 CA--C 1.534 1.252 0 C-N-CA 126.499 1.999 . . . . 10.0 114.665 174.161 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.467 ' HB2' HMC2 ' A' ' 90' ' ' HEC . 5.8 ttp -171.84 -39.05 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 127.686 2.394 . . . . 10.0 110.685 171.82 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -77.51 -31.21 53.35 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 122.097 -0.377 . . . . 10.0 111.782 -178.604 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 5.8 m 72.76 -62.4 0.47 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.686 1.194 . . . . 10.0 112.592 -178.19 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -79.3 54.28 1.66 Allowed 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.944 0.898 . . . . 10.0 110.579 -179.215 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -111.84 121.51 45.25 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 124.256 1.023 . . . . 10.0 109.718 -175.072 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 7.3 m -80.94 149.27 29.45 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.031 0.932 . . . . 10.0 110.53 -174.317 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -49.14 -40.21 31.76 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 120.121 1.328 . . . . 10.0 112.563 179.493 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -55.78 -38.8 70.39 Favored 'General case' 0 CA--C 1.545 0.755 0 N-CA-C 113.521 0.934 . . . . 10.0 113.521 173.54 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -84.66 -38.27 20.01 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.876 1.27 . . . . 10.0 111.382 177.245 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -63.38 -55.1 27.21 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.376 -1.452 . . . . 10.0 111.426 178.157 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.91 -48.99 74.43 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 107.573 -1.269 . . . . 10.0 107.573 -175.487 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.545 ' HB3' ' HB2' ' A' ' 3' ' ' ALA . . . -54.2 -31.52 53.21 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 112.367 0.506 . . . . 10.0 112.367 177.0 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -68.59 -50.14 53.94 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 119.206 0.912 . . . . 10.0 110.765 177.043 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 8.9 mt -60.54 -41.9 89.5 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.516 1.126 . . . . 10.0 111.701 176.232 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -65.41 -43.69 89.79 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.597 1.959 . . . . 10.0 112.374 175.138 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 77.8 t80 -55.61 -35.91 66.37 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 112.705 0.631 . . . . 10.0 112.705 174.501 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 56.2 mtm -76.61 -78.97 0.11 Allowed 'General case' 0 CA--C 1.543 0.705 0 N-CA-C 113.015 0.746 . . . . 10.0 113.015 179.787 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.4 t -151.62 37.06 0.58 Allowed 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.353 -0.842 . . . . 10.0 111.113 174.986 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 9.0 ptmt 39.74 58.02 2.13 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.45 1.5 . . . . 10.0 113.5 172.923 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.568 ' HB1' ' HB2' ' A' ' 34' ' ' ARG . . . -155.02 -75.82 0.11 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 115.022 -0.99 . . . . 10.0 113.435 177.783 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.52 ' HB2' HMA3 ' A' ' 90' ' ' HEC . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.245 0 C-N-CA 125.903 1.681 . . . . 10.0 112.978 -171.339 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' HEC . . . . . 0.893 HMC1 HBC3 ' A' ' 90' ' ' HEC . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_