data_4gbq_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 4gbq _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.733 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.433 ' H ' HG13 ' A' ' 53' ' ' ILE . 47.4 mm -143.7 116.37 3.03 Favored 'Isoleucine or valine' 0 C--N 1.349 0.574 0 CA-C-N 112.484 -2.143 . . . . 0.0 109.623 -175.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.27 125.89 27.84 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.185 177.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.1 mmmt -97.35 -26.0 15.03 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.002 -0.999 . . . . 0.0 113.055 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -142.08 168.28 20.11 Favored 'General case' 0 C--N 1.351 0.645 0 O-C-N 125.031 1.457 . . . . 0.0 107.847 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -68.98 145.43 53.6 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 113.591 -1.64 . . . . 0.0 109.129 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -146.95 128.92 15.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 116.946 -1.902 . . . . 0.0 111.166 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.2 mmtp -120.49 112.94 19.59 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 112.346 -2.207 . . . . 0.0 108.028 179.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.84 158.88 0.19 Allowed 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 123.408 1.575 . . . . 0.0 113.938 -177.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.1 p -114.28 -22.47 9.91 Favored 'General case' 0 C--N 1.346 0.417 0 CA-C-N 110.719 -2.946 . . . . 0.0 112.258 -177.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -154.03 173.05 16.53 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 113.354 -1.748 . . . . 0.0 111.238 -177.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -54.96 -31.27 60.49 Favored 'General case' 0 CA--C 1.553 1.078 0 CA-C-N 110.278 -3.147 . . . . 0.0 114.478 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 55.0 p-10 -88.88 -2.7 58.72 Favored 'General case' 0 C--N 1.353 0.739 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -178.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -112.94 156.6 22.73 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.011 -1.45 . . . . 0.0 108.552 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 pp -135.04 152.38 51.64 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 111.994 -2.366 . . . . 0.0 108.64 177.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . 0.281 57.7 m -82.23 170.88 14.91 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 112.013 -2.358 . . . . 0.0 112.462 -177.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -163.81 -176.58 4.67 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 108.709 -3.86 . . . . 0.0 106.501 172.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.27 144.54 36.51 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.87 102.16 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.247 0 O-C-N 125.068 1.48 . . . . 0.0 112.514 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 136.25 -24.03 3.27 Favored Glycine 0 C--N 1.355 1.635 0 CA-C-N 115.016 -0.993 . . . . 0.0 114.584 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -50.49 142.48 10.55 Favored 'General case' 0 C--N 1.359 1.01 0 CA-C-O 122.8 1.286 . . . . 0.0 114.2 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.7 mm -99.0 116.67 42.65 Favored 'Isoleucine or valine' 0 C--N 1.348 0.533 0 N-CA-C 102.156 -3.276 . . . . 0.0 102.156 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.1 mp -107.2 155.04 20.35 Favored 'General case' 0 C--N 1.349 0.545 0 O-C-N 124.606 1.191 . . . . 0.0 111.547 -176.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.63 110.92 23.01 Favored 'General case' 0 C--N 1.355 0.807 0 CA-C-N 111.343 -2.662 . . . . 0.0 108.854 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.9 t -87.42 106.96 16.67 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 C-N-CA 116.915 -1.914 . . . . 0.0 110.016 -176.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.7 tp . . . . . 0 CA--C 1.546 0.794 0 CA-C-N 112.148 -2.296 . . . . 0.0 107.516 179.212 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 49.5 m-20 . . . . . 0 CA--C 1.552 1.039 0 CA-C-O 118.269 -0.872 . . . . 0.0 113.212 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -140.26 166.41 24.75 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.776 0.798 . . . . 0.0 112.346 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -142.22 146.17 34.89 Favored 'General case' 0 C--N 1.357 0.923 0 CA-C-N 113.228 -1.806 . . . . 0.0 109.648 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.9 tttt -101.54 118.99 38.08 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 175.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.27 172.11 13.13 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 119.101 -1.04 . . . . 0.0 111.841 -177.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -109.77 136.23 49.42 Favored 'General case' 0 C--N 1.36 1.036 0 CA-C-N 114.128 -1.396 . . . . 0.0 111.227 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.283 11.2 mt -160.13 136.02 8.49 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-N 111.755 -2.475 . . . . 0.0 114.611 179.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 57.3 21.49 6.77 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 110.731 -2.94 . . . . 0.0 116.32 170.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 94.74 10.7 57.56 Favored Glycine 0 CA--C 1.538 1.489 0 O-C-N 124.299 0.999 . . . . 0.0 113.557 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -132.01 169.42 16.36 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-O 122.137 0.97 . . . . 0.0 108.939 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -141.51 129.82 22.34 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 112.37 -2.196 . . . . 0.0 107.51 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.07 -179.96 43.32 Favored Glycine 0 C--N 1.348 1.244 0 C-N-CA 118.768 -1.682 . . . . 0.0 111.842 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -77.52 146.34 36.42 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 113.121 -1.539 . . . . 0.0 110.825 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.6 pt -142.83 144.26 28.86 Favored Pre-proline 0 CA--C 1.542 0.666 0 CA-C-N 111.125 -2.761 . . . . 0.0 106.843 179.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -79.2 145.79 19.45 Favored 'Trans proline' 0 C--N 1.364 1.377 0 N-CA-C 115.417 1.276 . . . . 0.0 115.417 -178.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -67.37 -44.24 79.43 Favored 'General case' 0 C--N 1.358 0.958 0 CA-C-N 113.996 -1.456 . . . . 0.0 111.568 -177.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.292 0.7 OUTLIER -67.36 -10.21 48.88 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 116.794 -1.962 . . . . 0.0 114.255 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -93.62 -10.2 35.44 Favored 'General case' 0 C--N 1.359 1.003 0 CA-C-O 118.417 -0.802 . . . . 0.0 111.474 176.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.516 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -131.07 175.12 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-O 122.93 1.347 . . . . 0.0 110.088 179.864 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.516 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 33.3 tt0 -135.67 133.79 38.52 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 111.931 -2.395 . . . . 0.0 106.666 176.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 5.5 mtm . . . . . 0 C--N 1.348 0.522 0 CA-C-N 114.55 -1.205 . . . . 0.0 109.481 178.635 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo . . . . . 0 N--CA 1.446 -1.27 0 N-CA-C 115.069 1.142 . . . . 0.0 115.069 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -55.84 159.67 11.31 Favored 'Trans proline' 0 C--N 1.365 1.439 0 C-N-CA 122.453 2.102 . . . . 0.0 116.813 177.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -72.13 127.29 12.61 Favored 'Trans proline' 0 C--N 1.365 1.4 0 N-CA-C 105.822 -2.415 . . . . 0.0 105.822 173.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.43 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 3.0 t -71.33 149.55 94.02 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 118.107 -1.437 . . . . 0.0 109.438 -177.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' PRO . . . . . 0.43 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 15.7 Cg_exo -71.09 155.25 61.77 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 O-C-N 123.539 1.284 . . . . 0.0 114.797 178.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -70.54 123.42 9.83 Favored 'Trans proline' 0 CA--C 1.548 1.186 0 N-CA-C 106.306 -2.228 . . . . 0.0 106.306 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.352 0.705 0 C-N-CA 118.639 -1.224 . . . . 0.0 109.046 -179.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.507 0 CA-C-O 122.17 0.986 . . . . 0.0 109.392 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.1 mt -147.0 116.17 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.646 0 CA-C-N 111.422 -2.626 . . . . 0.0 109.526 -178.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.27 129.51 40.13 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.747 177.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.0 mmmt -96.46 -23.67 16.47 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 113.797 -1.547 . . . . 0.0 113.291 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -141.92 168.81 18.88 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 125.203 1.564 . . . . 0.0 108.046 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -68.82 146.89 52.48 Favored 'General case' 0 C--N 1.357 0.892 0 CA-C-N 113.283 -1.781 . . . . 0.0 107.429 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -146.87 133.6 20.0 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 117.4 -1.72 . . . . 0.0 108.837 176.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm -122.08 112.17 17.91 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 113.88 -1.509 . . . . 0.0 107.056 177.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.9 154.63 0.7 Allowed 'General case' 0 C--N 1.381 1.943 0 CA-C-O 121.942 0.877 . . . . 0.0 112.639 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.9 p -113.26 -17.2 12.38 Favored 'General case' 0 C--N 1.36 1.035 0 CA-C-N 112.372 -2.195 . . . . 0.0 113.964 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.58 163.25 39.47 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 114.226 -1.352 . . . . 0.0 109.041 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -52.12 -30.63 27.19 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 110.709 -2.95 . . . . 0.0 115.008 -177.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 48.1 p-10 -87.97 -1.5 58.03 Favored 'General case' 0 C--N 1.358 0.971 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -177.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -109.1 160.04 16.38 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 113.835 -1.53 . . . . 0.0 108.125 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.13 151.88 51.11 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 179.12 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 25.9 m -83.04 168.27 17.09 Favored 'General case' 0 CA--C 1.56 1.365 0 CA-C-N 112.851 -1.977 . . . . 0.0 113.753 -178.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -164.08 -174.19 3.47 Favored 'General case' 0 C--N 1.354 0.766 0 CA-C-N 112.591 -2.095 . . . . 0.0 107.818 173.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.86 146.22 40.95 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 112.968 -1.924 . . . . 0.0 105.842 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -47.23 102.48 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.254 0 O-C-N 125.575 1.797 . . . . 0.0 111.537 178.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 127.05 -16.38 6.41 Favored Glycine 0 CA--C 1.541 1.678 0 CA-C-N 113.327 -1.76 . . . . 0.0 116.055 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -52.42 147.75 7.72 Favored 'General case' 0 C--N 1.365 1.255 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -177.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 88.0 mt -99.14 113.43 34.03 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 175.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.5 mp -107.71 160.05 16.01 Favored 'General case' 0 C--N 1.35 0.627 0 CA-C-O 122.86 1.314 . . . . 0.0 110.664 -178.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.4 ttmt -101.6 112.35 24.89 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 109.911 -3.313 . . . . 0.0 106.747 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 25.0 t -87.8 98.1 7.23 Favored 'Isoleucine or valine' 0 C--N 1.349 0.558 0 C-N-CA 113.058 -3.457 . . . . 0.0 108.494 -177.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.353 0.721 0 CA-C-N 112.587 -2.097 . . . . 0.0 107.185 177.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 . . . . . 0 N--CA 1.442 -0.855 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -137.97 153.94 49.4 Favored 'General case' 0 C--N 1.363 1.155 0 O-C-N 123.638 0.586 . . . . 0.0 109.997 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -130.61 151.54 50.96 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -100.72 122.17 42.91 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 178.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -143.53 168.13 20.59 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 118.736 -1.186 . . . . 0.0 113.61 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -111.59 135.16 52.55 Favored 'General case' 0 C--N 1.368 1.387 0 O-C-N 125.396 1.685 . . . . 0.0 111.13 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.298 12.4 mt -162.97 143.77 9.55 Favored 'General case' 0 C--N 1.345 0.372 0 CA-C-N 110.695 -2.957 . . . . 0.0 113.93 177.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.58 29.62 18.71 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 110.479 -3.055 . . . . 0.0 115.501 170.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 75.77 18.61 79.57 Favored Glycine 0 CA--C 1.545 1.954 0 CA-C-N 114.434 -1.257 . . . . 0.0 114.088 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -138.93 171.38 14.42 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 124.828 1.251 . . . . 0.0 109.352 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -143.05 139.67 30.62 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 112.145 -2.298 . . . . 0.0 108.252 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -179.24 177.37 48.35 Favored Glycine 0 C--N 1.349 1.264 0 C-N-CA 118.977 -1.582 . . . . 0.0 112.386 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -77.68 145.92 36.34 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-N 113.311 -1.445 . . . . 0.0 110.164 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.6 pt -141.79 144.78 34.1 Favored Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 111.961 -2.381 . . . . 0.0 107.56 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -76.7 149.58 30.16 Favored 'Trans proline' 0 C--N 1.369 1.629 0 N-CA-C 116.028 1.511 . . . . 0.0 116.028 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.15 -49.26 62.14 Favored 'General case' 0 C--N 1.353 0.732 0 CA-C-N 112.718 -2.037 . . . . 0.0 111.434 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.253 0.7 OUTLIER -65.54 -7.58 15.33 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 117.08 -1.848 . . . . 0.0 115.92 -179.307 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -93.04 -11.1 33.89 Favored 'General case' 0 C--N 1.358 0.97 0 CA-C-O 118.34 -0.838 . . . . 0.0 112.495 177.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.469 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -128.06 170.32 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-O 122.346 1.07 . . . . 0.0 108.82 178.52 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.469 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 17.7 tt0 -128.46 132.96 48.42 Favored 'General case' 0 C--N 1.354 0.775 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.532 0.265 0 CA-C-N 112.437 -2.165 . . . . 0.0 111.036 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 CA--C 1.553 1.471 0 N-CA-C 117.245 1.979 . . . . 0.0 117.245 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -59.21 160.31 19.68 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 124.341 3.361 . . . . 0.0 117.01 177.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -76.17 118.9 5.12 Favored 'Trans proline' 0 C--N 1.368 1.563 0 N-CA-C 106.314 -2.226 . . . . 0.0 106.314 174.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.433 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 3.1 t -62.73 147.35 93.37 Favored Pre-proline 0 CA--C 1.538 0.515 0 CA-C-N 113.001 -1.909 . . . . 0.0 109.739 -178.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' PRO . . . . . 0.433 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 18.1 Cg_exo -66.66 157.41 61.06 Favored 'Trans proline' 0 C--N 1.359 1.097 0 O-C-N 123.137 1.072 . . . . 0.0 114.468 178.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -67.69 120.88 7.9 Favored 'Trans proline' 0 C--N 1.365 1.411 0 N-CA-C 105.904 -2.383 . . . . 0.0 105.904 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.357 0.928 0 O-C-N 124.492 1.12 . . . . 0.0 110.778 -178.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.347 0 CA-C-O 121.779 0.8 . . . . 0.0 109.362 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.421 ' H ' HG13 ' A' ' 53' ' ' ILE . 15.1 mt -149.03 120.03 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.635 0 CA-C-N 112.297 -2.229 . . . . 0.0 108.745 -177.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 128.38 36.35 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.602 -1.635 . . . . 0.0 111.883 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.45 -24.77 15.95 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 114.42 -1.263 . . . . 0.0 113.315 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -139.89 167.61 21.72 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 118.946 -1.102 . . . . 0.0 108.781 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -67.61 145.98 54.31 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 113.725 -1.579 . . . . 0.0 108.135 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -146.66 136.5 23.27 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 122.6 1.191 . . . . 0.0 109.591 176.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.13 106.57 9.66 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 112.776 -2.011 . . . . 0.0 108.003 178.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.11 157.97 0.16 Allowed 'General case' 0 C--N 1.36 1.023 0 CA-C-O 122.631 1.205 . . . . 0.0 113.753 -178.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.9 p -112.84 -17.96 12.39 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 110.942 -2.845 . . . . 0.0 112.054 -177.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.71 169.02 24.34 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 123.071 1.415 . . . . 0.0 111.812 -176.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -50.53 -36.36 33.89 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 110.59 -3.004 . . . . 0.0 112.913 -179.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 39.3 p30 -87.38 -1.4 57.9 Favored 'General case' 0 C--N 1.356 0.851 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -107.69 157.75 17.84 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 124.368 1.042 . . . . 0.0 108.419 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -132.74 155.12 49.45 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 114.047 -1.433 . . . . 0.0 107.187 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.8 m -84.3 171.5 12.65 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 123.661 1.696 . . . . 0.0 114.055 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -167.43 163.62 14.98 Favored 'General case' 0 C--N 1.347 0.465 0 CA-C-N 111.364 -2.653 . . . . 0.0 107.976 174.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -127.39 141.06 51.79 Favored 'General case' 0 C--O 1.223 -0.316 0 N-CA-C 105.45 -2.055 . . . . 0.0 105.45 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -40.81 99.63 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.061 0 O-C-N 125.986 2.054 . . . . 0.0 113.843 -176.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 129.55 -7.75 6.21 Favored Glycine 0 C--N 1.36 1.884 0 CA-C-N 113.562 -1.654 . . . . 0.0 116.115 178.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -61.61 146.76 47.92 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 117.334 -1.746 . . . . 0.0 112.783 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 26.6 mm -99.08 112.85 32.3 Favored 'Isoleucine or valine' 0 C--N 1.347 0.474 0 N-CA-C 104.516 -2.401 . . . . 0.0 104.516 177.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.1 mp -107.16 160.92 15.21 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 118.301 -1.36 . . . . 0.0 111.693 -175.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.08 113.97 27.89 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 110.403 -3.089 . . . . 0.0 107.737 177.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.5 t -85.86 121.29 37.13 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 C-N-CA 116.486 -2.086 . . . . 0.0 106.885 -177.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 27.2 tp . . . . . 0 C--N 1.345 0.39 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.581 -175.961 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.6 m120 . . . . . 0 CA--C 1.551 0.99 0 CA-C-O 118.448 -0.787 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.8 m95 -136.91 153.28 50.78 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -178.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -127.02 147.97 50.13 Favored 'General case' 0 C--N 1.355 0.846 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 178.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -102.03 116.28 32.35 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 104.133 -2.544 . . . . 0.0 104.133 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.38 173.74 11.29 Favored 'General case' 0 C--N 1.349 0.574 0 C-N-CA 119.086 -1.046 . . . . 0.0 111.154 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -109.26 141.83 41.0 Favored 'General case' 0 C--N 1.359 1.003 0 O-C-N 125.64 1.837 . . . . 0.0 110.675 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 mt -158.66 119.47 3.33 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 110.575 -3.011 . . . . 0.0 115.76 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.367 0.0 OUTLIER 61.87 33.17 17.74 Favored 'General case' 0 C--N 1.384 2.092 1 C-N-CA 110.051 -4.66 . . . . 0.0 118.564 173.671 . . . . . . . . 4 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.62 22.39 59.28 Favored Glycine 0 CA--C 1.546 2.022 0 C-N-CA 116.227 -2.892 . . . . 0.0 112.384 -178.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.45 137.22 47.18 Favored 'General case' 0 C--N 1.353 0.72 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 179.424 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 18.4 p-10 -130.17 145.77 51.75 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 -178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 176.19 178.79 46.25 Favored Glycine 0 C--N 1.34 0.769 0 C-N-CA 116.313 -2.851 . . . . 0.0 112.388 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -76.93 143.03 39.82 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-O 123.414 1.578 . . . . 0.0 109.331 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.2 pt -143.37 144.19 27.12 Favored Pre-proline 0 C--O 1.218 -0.556 0 CA-C-N 111.412 -2.631 . . . . 0.0 106.195 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -77.09 147.53 26.58 Favored 'Trans proline' 0 C--N 1.356 0.968 0 N-CA-C 116.237 1.591 . . . . 0.0 116.237 -177.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.14 -45.76 66.14 Favored 'General case' 0 C--N 1.358 0.938 0 C-N-CA 116.922 -1.911 . . . . 0.0 110.843 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.313 0.5 OUTLIER -62.6 -7.38 4.64 Favored 'General case' 0 CA--C 1.557 1.235 0 C-N-CA 115.137 -2.625 . . . . 0.0 115.617 -177.838 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -93.42 -10.52 34.86 Favored 'General case' 0 CA--C 1.559 1.302 0 CA-C-O 118.738 -0.648 . . . . 0.0 111.611 176.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.433 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -127.3 168.85 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-O 122.314 1.054 . . . . 0.0 108.707 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.433 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 3.5 tt0 -120.94 136.66 54.91 Favored 'General case' 0 C--N 1.352 0.694 0 N-CA-C 103.11 -2.922 . . . . 0.0 103.11 176.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.224 -0.248 0 CA-C-N 113.233 -1.803 . . . . 0.0 110.212 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.436 -1.91 0 N-CA-C 115.563 1.332 . . . . 0.0 115.563 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -58.95 158.41 25.17 Favored 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 122.36 2.04 . . . . 0.0 115.89 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -70.14 119.57 6.47 Favored 'Trans proline' 0 C--N 1.362 1.271 0 N-CA-C 106.07 -2.319 . . . . 0.0 106.07 175.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 16.6 t -64.63 149.34 95.76 Favored Pre-proline 0 CA--C 1.543 0.7 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.995 -177.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.05 158.66 53.22 Favored 'Trans proline' 0 C--N 1.362 1.256 0 O-C-N 123.052 1.027 . . . . 0.0 114.361 178.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -78.89 118.52 4.12 Favored 'Trans proline' 0 C--N 1.358 1.027 0 N-CA-C 106.549 -2.135 . . . . 0.0 106.549 176.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.352 0.694 0 C-N-CA 117.287 -1.765 . . . . 0.0 109.2 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.491 0 CA-C-O 122.935 1.35 . . . . 0.0 108.68 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.275 16.4 mm -145.47 118.39 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-N 110.587 -3.006 . . . . 0.0 108.888 -176.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.45 125.54 26.81 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 117.054 -1.858 . . . . 0.0 107.83 176.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.8 mtmt -95.2 -24.89 16.61 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.467 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 52.2 m-85 -141.46 167.41 22.23 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -67.93 147.0 53.07 Favored 'General case' 0 C--N 1.352 0.698 0 CA-C-N 114.049 -1.432 . . . . 0.0 107.494 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -147.37 129.64 15.66 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 116.819 -1.952 . . . . 0.0 110.214 176.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.5 116.42 24.66 Favored 'General case' 0 CA--C 1.569 1.687 0 CA-C-N 113.699 -1.591 . . . . 0.0 107.407 177.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.58 159.87 0.09 Allowed 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 123.537 1.637 . . . . 0.0 115.185 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 28.4 p -119.14 -15.64 9.19 Favored 'General case' 0 C--N 1.353 0.751 0 CA-C-N 110.162 -3.199 . . . . 0.0 114.057 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.09 160.45 43.43 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 123.052 1.406 . . . . 0.0 111.443 -178.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -49.28 -32.2 10.42 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-N 111.066 -2.788 . . . . 0.0 113.462 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -89.32 -2.16 58.34 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.988 1.847 . . . . 0.0 115.988 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -106.89 162.82 13.48 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 114.051 -1.432 . . . . 0.0 107.761 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -134.58 152.4 51.75 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.058 -1.428 . . . . 0.0 107.824 179.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.2 m -85.0 164.76 18.07 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 124.31 2.005 . . . . 0.0 113.048 -178.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -162.16 178.59 8.63 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 111.431 -2.622 . . . . 0.0 108.168 173.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.19 145.98 44.35 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 111.853 -2.431 . . . . 0.0 104.723 -178.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -47.48 100.43 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 O-C-N 125.69 1.869 . . . . 0.0 112.191 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.59 -14.7 5.54 Favored Glycine 0 C--N 1.353 1.482 0 CA-C-O 118.634 -1.092 . . . . 0.0 115.548 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -53.71 146.09 14.19 Favored 'General case' 0 C--N 1.365 1.269 0 C-N-CA 118.746 -1.182 . . . . 0.0 112.289 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.3 mm -95.6 116.45 37.28 Favored 'Isoleucine or valine' 0 C--N 1.352 0.688 0 N-CA-C 100.876 -3.75 . . . . 0.0 100.876 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.61 153.19 22.72 Favored 'General case' 0 C--N 1.348 0.52 0 CA-C-N 113.174 -1.83 . . . . 0.0 111.363 -175.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -104.58 109.06 20.81 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 109.798 -3.364 . . . . 0.0 109.288 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 55.8 t -86.92 110.31 20.18 Favored 'Isoleucine or valine' 0 C--N 1.344 0.356 0 C-N-CA 116.687 -2.005 . . . . 0.0 110.065 -176.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.2 tp . . . . . 0 CA--C 1.551 0.984 0 CA-C-N 112.792 -2.003 . . . . 0.0 109.325 179.903 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 . . . . . 0 N--CA 1.436 -1.135 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -135.21 159.27 42.07 Favored 'General case' 0 CA--C 1.553 1.069 0 O-C-N 124.82 1.325 . . . . 0.0 109.218 -179.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -134.96 148.23 49.96 Favored 'General case' 0 C--N 1.354 0.78 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.5 ttpp -99.89 117.92 35.22 Favored 'General case' 0 C--N 1.354 0.799 0 N-CA-C 104.442 -2.429 . . . . 0.0 104.442 177.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.48 176.84 8.38 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 113.815 -1.539 . . . . 0.0 111.061 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -126.61 143.79 51.11 Favored 'General case' 0 C--N 1.356 0.871 0 O-C-N 125.33 1.644 . . . . 0.0 110.856 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.289 10.8 mt -161.9 142.62 10.61 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 109.766 -3.379 . . . . 0.0 113.084 178.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.94 30.3 18.93 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 111.544 -2.571 . . . . 0.0 116.352 170.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.95 11.61 85.23 Favored Glycine 0 CA--C 1.545 1.95 0 C-N-CA 119.305 -1.426 . . . . 0.0 114.975 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -136.08 165.24 26.16 Favored 'General case' 0 C--N 1.352 0.689 0 C-N-CA 124.448 1.099 . . . . 0.0 108.055 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -139.44 139.06 36.96 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 112.84 -1.982 . . . . 0.0 108.011 -179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.48 178.26 44.67 Favored Glycine 0 C--N 1.344 0.988 0 C-N-CA 118.105 -1.998 . . . . 0.0 111.707 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -77.78 146.0 36.09 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 112.628 -1.786 . . . . 0.0 110.369 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 35.0 pt -141.88 143.27 27.95 Favored Pre-proline 0 C--N 1.349 0.551 0 CA-C-N 112.128 -2.306 . . . . 0.0 106.023 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -75.1 139.42 24.0 Favored 'Trans proline' 0 C--N 1.362 1.273 0 CA-C-N 118.972 0.669 . . . . 0.0 112.664 -178.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.7 pttp -70.05 -21.13 63.2 Favored 'General case' 0 C--N 1.358 0.974 0 C-N-CA 114.761 -2.776 . . . . 0.0 112.978 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.62 -18.9 61.55 Favored 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 113.544 -3.262 . . . . 0.0 111.329 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -87.54 -6.87 58.15 Favored 'General case' 0 C--N 1.367 1.358 0 O-C-N 123.851 0.719 . . . . 0.0 112.528 -175.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -129.76 172.28 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 CA-C-O 121.893 0.854 . . . . 0.0 108.827 177.75 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.459 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 2.4 tt0 -132.87 136.22 46.08 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 112.848 -1.978 . . . . 0.0 105.938 177.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 55.2 mtm . . . . . 0 CA--C 1.538 0.506 0 CA-C-N 112.721 -2.036 . . . . 0.0 110.736 -179.18 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . 0.467 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 1.9 Cg_endo . . . . . 0 CA--C 1.564 2.013 0 N-CA-C 115.007 1.118 . . . . 0.0 115.007 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -57.69 158.12 21.16 Favored 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 124.056 3.17 . . . . 0.0 117.627 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -71.61 114.05 3.83 Favored 'Trans proline' 0 C--N 1.357 0.989 0 N-CA-C 106.885 -2.006 . . . . 0.0 106.885 175.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.43 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.1 t -54.58 148.27 26.25 Favored Pre-proline 0 C--N 1.354 0.782 0 CA-C-N 113.473 -1.694 . . . . 0.0 109.864 -178.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' PRO . . . . . 0.43 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 21.0 Cg_exo -64.38 153.83 74.7 Favored 'Trans proline' 0 C--N 1.359 1.129 0 N-CA-C 114.977 1.107 . . . . 0.0 114.977 178.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -76.63 111.05 3.17 Favored 'Trans proline' 0 C--N 1.362 1.242 0 N-CA-C 107.462 -1.784 . . . . 0.0 107.462 176.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? . . . . . 0 C--N 1.349 0.544 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.395 -179.476 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.422 0 N-CA-C 105.287 -2.116 . . . . 0.0 105.287 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 mt -154.43 134.35 3.97 Favored 'Isoleucine or valine' 0 C--N 1.348 0.508 0 C-N-CA 117.553 -1.659 . . . . 0.0 109.59 -175.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.92 129.45 39.94 Favored 'General case' 0 CA--C 1.557 1.214 0 CA-C-N 112.504 -2.135 . . . . 0.0 109.596 177.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -97.44 -27.19 14.56 Favored 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 113.839 -1.528 . . . . 0.0 111.954 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -142.44 170.46 15.66 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 113.32 -1.763 . . . . 0.0 106.956 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.32 142.87 47.1 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 118.807 -1.157 . . . . 0.0 108.413 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -147.18 127.17 13.63 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 117.418 -1.713 . . . . 0.0 111.225 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.94 118.78 33.9 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 112.763 -2.017 . . . . 0.0 108.142 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.85 151.53 1.2 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 122.181 0.991 . . . . 0.0 112.216 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.79 -11.0 9.06 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-N 112.06 -2.336 . . . . 0.0 112.126 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.43 164.99 37.21 Favored 'General case' 0 C--N 1.356 0.885 0 CA-C-O 123.847 1.784 . . . . 0.0 110.338 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -47.77 -34.67 8.81 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 108.842 -3.799 . . . . 0.0 114.697 -178.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -93.87 0.68 56.31 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 26.7 mp0 -112.97 154.55 26.27 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.399 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.9 pp -134.54 154.92 51.22 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 112.807 -1.997 . . . . 0.0 109.854 177.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . 0.255 58.5 m -82.1 166.7 19.48 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 111.213 -2.721 . . . . 0.0 113.143 -177.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.9 p90 -163.9 -175.95 4.32 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 110.248 -3.16 . . . . 0.0 107.419 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.8 143.82 37.05 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 111.918 -2.401 . . . . 0.0 105.509 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -46.67 98.57 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.441 0 O-C-N 125.168 1.543 . . . . 0.0 112.866 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 131.11 -13.28 5.5 Favored Glycine 0 C--N 1.356 1.66 0 O-C-N 124.525 1.14 . . . . 0.0 115.535 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -54.52 145.77 17.8 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 119.109 -1.037 . . . . 0.0 112.684 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.8 mm -97.0 117.0 40.74 Favored 'Isoleucine or valine' 0 C--N 1.352 0.686 0 N-CA-C 103.09 -2.93 . . . . 0.0 103.09 177.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -111.04 148.48 32.52 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 112.173 -2.285 . . . . 0.0 112.542 -175.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.14 107.54 18.56 Favored 'General case' 0 C--O 1.213 -0.832 0 CA-C-N 110.705 -2.952 . . . . 0.0 108.475 178.153 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -86.34 99.0 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 C-N-CA 115.133 -2.627 . . . . 0.0 109.778 -176.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.1 tp . . . . . 0 C--N 1.344 0.357 0 CA-C-N 110.509 -3.041 . . . . 0.0 107.292 178.824 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.9 m120 . . . . . 0 N--CA 1.436 -1.125 0 N-CA-C 115.288 1.588 . . . . 0.0 115.288 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.422 ' CE2' ' HB3' ' B' ' 8' ' ' ARG . 70.5 m95 -132.55 153.98 50.44 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 119.053 0.842 . . . . 0.0 110.929 -178.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.408 ' O ' ' HA ' ' A' ' 47' ' ' PHE 0.261 21.4 m-85 -133.46 148.51 51.74 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 114.595 -1.184 . . . . 0.0 108.514 177.634 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -99.19 119.35 37.72 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 179.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.04 172.54 12.54 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 119.181 -1.008 . . . . 0.0 112.162 -176.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -113.7 134.39 54.78 Favored 'General case' 0 C--N 1.362 1.139 0 O-C-N 125.15 1.531 . . . . 0.0 111.915 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.342 9.4 mt -161.2 137.55 8.35 Favored 'General case' 0 C--N 1.355 0.813 0 CA-C-N 111.662 -2.517 . . . . 0.0 114.565 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.9 21.14 5.85 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 110.218 -3.174 . . . . 0.0 116.661 170.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 91.96 15.22 54.87 Favored Glycine 0 C--N 1.353 1.486 0 CA-C-N 114.359 -1.292 . . . . 0.0 113.287 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -134.3 166.74 22.11 Favored 'General case' 0 C--N 1.354 0.773 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -141.96 129.64 21.56 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 112.773 -2.012 . . . . 0.0 107.546 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.49 178.56 44.53 Favored Glycine 0 C--N 1.353 1.493 0 C-N-CA 119.318 -1.42 . . . . 0.0 111.995 -177.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . 0.408 ' HA ' ' O ' ' A' ' 37' ' ' TYR . 69.3 m-85 -77.86 146.28 35.77 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 123.062 1.411 . . . . 0.0 113.481 -178.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.2 pt -141.18 144.15 33.54 Favored Pre-proline 0 C--N 1.354 0.788 0 CA-C-N 111.21 -2.723 . . . . 0.0 107.104 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.13 150.49 37.7 Favored 'Trans proline' 0 C--N 1.364 1.383 0 N-CA-C 116.327 1.626 . . . . 0.0 116.327 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . 0.342 0.1 OUTLIER -65.97 -45.39 81.87 Favored 'General case' 0 C--N 1.364 1.227 0 CA-C-N 114.043 -1.435 . . . . 0.0 111.446 179.622 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.319 0.7 OUTLIER -68.66 -11.89 60.7 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 116.116 -2.234 . . . . 0.0 114.306 -178.534 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -92.44 -12.56 31.79 Favored 'General case' 0 C--N 1.357 0.924 0 CA-C-O 117.754 -1.117 . . . . 0.0 112.374 177.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.446 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -133.14 168.67 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-O 122.303 1.049 . . . . 0.0 109.2 178.925 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.446 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 2.0 tt0 -136.92 137.63 39.78 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 113.185 -1.825 . . . . 0.0 107.823 176.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.2 mtm . . . . . 0 C--N 1.349 0.579 0 CA-C-N 113.707 -1.588 . . . . 0.0 109.072 178.78 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo . . . . . 0 N--CA 1.445 -1.365 0 N-CA-C 114.337 0.86 . . . . 0.0 114.337 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -51.83 160.19 3.08 Favored 'Trans proline' 0 C--N 1.364 1.379 0 C-N-CA 122.652 2.235 . . . . 0.0 116.999 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -72.97 126.73 11.5 Favored 'Trans proline' 0 C--N 1.367 1.525 0 N-CA-C 105.762 -2.438 . . . . 0.0 105.762 175.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.411 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 10.7 t -70.74 146.71 93.8 Favored Pre-proline 0 CA--C 1.54 0.584 0 C-N-CA 117.688 -1.605 . . . . 0.0 108.92 -177.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' PRO . . . . . 0.411 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 12.5 Cg_exo -67.9 160.08 50.02 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 O-C-N 123.358 1.188 . . . . 0.0 114.806 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -78.57 116.54 3.83 Favored 'Trans proline' 0 CA--C 1.551 1.329 0 N-CA-C 108.405 -1.421 . . . . 0.0 108.405 176.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.422 ' HB3' ' CE2' ' A' ' 36' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.352 0.686 0 CA-C-N 114.304 -1.316 . . . . 0.0 108.865 179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.769 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.1 mt -148.98 120.93 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 111.381 -2.645 . . . . 0.0 108.23 -176.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.96 134.08 49.05 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 113.325 -1.761 . . . . 0.0 108.401 176.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt -94.22 -22.3 18.5 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 124.415 1.086 . . . . 0.0 112.563 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.419 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 88.0 m-85 -142.33 170.29 15.98 Favored 'General case' 0 C--N 1.35 0.611 0 CA-C-N 113.935 -1.484 . . . . 0.0 108.394 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -72.51 149.29 44.24 Favored 'General case' 0 C--O 1.214 -0.8 0 CA-C-N 113.348 -1.751 . . . . 0.0 108.017 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -145.95 134.61 22.23 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 117.693 -1.603 . . . . 0.0 109.409 176.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -122.37 101.25 7.39 Favored 'General case' 0 CA--C 1.561 1.373 0 CA-C-N 111.694 -2.503 . . . . 0.0 109.773 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.55 152.69 0.89 Allowed 'General case' 0 C--N 1.362 1.131 0 CA-C-O 122.123 0.963 . . . . 0.0 113.028 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.1 p -118.84 -11.81 9.7 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-N 111.848 -2.433 . . . . 0.0 113.156 -177.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.22 163.58 38.53 Favored 'General case' 0 C--N 1.355 0.809 0 CA-C-O 123.323 1.535 . . . . 0.0 110.201 -178.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -49.08 -31.35 7.75 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 110.332 -3.122 . . . . 0.0 115.343 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 57.4 p30 -90.74 -4.13 56.93 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -109.77 158.09 18.48 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 113.693 -1.594 . . . . 0.0 107.791 -179.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.41 152.22 51.89 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 111.624 -2.535 . . . . 0.0 108.134 178.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.3 m -82.94 166.09 19.16 Favored 'General case' 0 C--N 1.354 0.765 0 CA-C-N 112.516 -2.129 . . . . 0.0 112.65 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -163.7 -175.21 4.02 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 111.145 -2.752 . . . . 0.0 107.646 172.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -139.37 147.31 41.33 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.93 100.72 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.031 0 O-C-N 125.269 1.605 . . . . 0.0 112.651 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 129.7 -19.01 5.34 Favored Glycine 0 C--N 1.353 1.476 0 CA-C-O 117.94 -1.478 . . . . 0.0 115.415 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -47.73 149.93 1.15 Allowed 'General case' 0 C--N 1.366 1.325 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -177.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mm -97.14 112.65 29.63 Favored 'Isoleucine or valine' 0 C--N 1.35 0.59 0 N-CA-C 103.54 -2.763 . . . . 0.0 103.54 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.1 mp -108.79 146.47 33.55 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-N 114.083 -1.417 . . . . 0.0 111.992 -175.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.34 112.49 25.4 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-N 111.877 -2.419 . . . . 0.0 107.546 179.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 12.0 t -87.87 99.58 8.98 Favored 'Isoleucine or valine' 0 C--N 1.352 0.679 0 C-N-CA 114.015 -3.074 . . . . 0.0 110.954 -175.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.7 mm? . . . . . 0 C--N 1.358 0.938 0 CA-C-N 112.976 -1.92 . . . . 0.0 106.009 177.115 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 43.4 m-20 . . . . . 0 N--CA 1.442 -0.856 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -134.03 155.82 49.32 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -136.17 153.61 51.21 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 114.05 -1.432 . . . . 0.0 108.514 177.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.9 ttmt -100.69 123.45 44.91 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 106.525 -1.658 . . . . 0.0 106.525 177.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -142.05 173.44 11.52 Favored 'General case' 0 C--N 1.352 0.677 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.683 -178.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 50.8 tt0 -120.92 136.66 54.9 Favored 'General case' 0 C--N 1.367 1.339 0 O-C-N 124.939 1.399 . . . . 0.0 111.062 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.264 12.3 mt -160.34 142.38 12.82 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 110.222 -3.172 . . . . 0.0 113.655 178.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.03 24.66 9.81 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 109.08 -3.691 . . . . 0.0 115.62 171.297 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.03 14.49 66.89 Favored Glycine 0 C--N 1.357 1.726 0 CA-C-N 114.64 -1.163 . . . . 0.0 113.867 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -134.35 168.13 19.47 Favored 'General case' 0 C--N 1.35 0.605 0 C-N-CA 125.013 1.325 . . . . 0.0 108.662 -179.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -139.49 141.51 37.35 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 112.401 -2.181 . . . . 0.0 107.74 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -177.91 177.95 48.42 Favored Glycine 0 C--N 1.348 1.227 0 C-N-CA 118.268 -1.92 . . . . 0.0 112.755 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -77.94 143.35 37.73 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 112.759 -1.72 . . . . 0.0 111.302 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.5 pt -141.89 143.39 28.4 Favored Pre-proline 0 C--N 1.351 0.662 0 CA-C-N 111.597 -2.547 . . . . 0.0 106.611 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -78.45 151.29 25.75 Favored 'Trans proline' 0 C--N 1.364 1.352 0 N-CA-C 116.775 1.798 . . . . 0.0 116.775 -177.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -44.12 81.93 Favored 'General case' 0 C--N 1.365 1.275 0 C-N-CA 118.159 -1.416 . . . . 0.0 112.002 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.323 0.7 OUTLIER -66.2 -10.77 44.89 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 116.263 -2.175 . . . . 0.0 115.839 -178.787 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -93.96 -10.55 33.33 Favored 'General case' 0 C--N 1.357 0.923 0 CA-C-O 117.356 -1.307 . . . . 0.0 110.911 177.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.5 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -129.95 169.75 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 CA-C-O 123.071 1.415 . . . . 0.0 109.778 179.211 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.5 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 28.2 tt0 -135.35 133.51 38.84 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 111.179 -2.737 . . . . 0.0 106.198 177.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 38.0 mtp . . . . . 0 C--N 1.353 0.748 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.824 -179.699 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . 0.419 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 5.6 Cg_exo . . . . . 0 N--CA 1.443 -1.454 0 CA-C-O 121.543 0.56 . . . . 0.0 112.297 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -49.87 156.13 3.57 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.224 1.949 . . . . 0.0 115.846 178.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -70.43 128.06 14.9 Favored 'Trans proline' 0 C--N 1.365 1.435 0 N-CA-C 107.011 -1.957 . . . . 0.0 107.011 176.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 13.3 t -73.59 145.95 85.39 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-N 113.92 -1.491 . . . . 0.0 108.511 -177.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -64.35 158.47 48.82 Favored 'Trans proline' 0 C--N 1.358 1.072 0 O-C-N 123.3 1.158 . . . . 0.0 114.535 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.55 118.38 5.48 Favored 'Trans proline' 0 C--N 1.36 1.136 0 N-CA-C 108.453 -1.403 . . . . 0.0 108.453 176.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.353 0.733 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.598 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.402 ' H ' HG13 ' A' ' 53' ' ' ILE 0.26 20.8 mt -147.19 116.19 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-N 111.963 -2.38 . . . . 0.0 109.305 -176.202 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.85 123.29 20.57 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 118.333 -1.347 . . . . 0.0 108.301 176.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -95.77 -23.56 16.9 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -141.16 163.32 33.28 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 125.355 1.659 . . . . 0.0 106.996 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -65.08 147.01 54.25 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 113.509 -1.678 . . . . 0.0 109.354 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -144.3 136.89 26.79 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 117.38 -1.728 . . . . 0.0 109.662 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -123.97 102.52 7.81 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 112.748 -2.024 . . . . 0.0 110.192 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.62 152.63 0.92 Allowed 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.381 1.086 . . . . 0.0 112.222 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.9 p -114.65 -14.42 12.05 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 111.464 -2.607 . . . . 0.0 114.306 -177.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -150.77 167.52 27.17 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-O 123.326 1.536 . . . . 0.0 110.049 -177.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -54.74 -30.48 56.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 110.018 -3.265 . . . . 0.0 113.907 -178.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 59.3 p30 -91.96 -2.8 56.57 Favored 'General case' 0 C--N 1.353 0.741 0 N-CA-C 114.857 1.429 . . . . 0.0 114.857 -177.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -108.84 156.01 20.14 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 125.012 1.445 . . . . 0.0 108.411 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.35 152.73 51.73 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 113.66 -1.609 . . . . 0.0 107.146 179.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 25.0 m -83.0 166.69 18.6 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 112.805 -1.998 . . . . 0.0 113.636 -178.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -164.04 174.25 11.57 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-N 112.4 -2.182 . . . . 0.0 107.887 174.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 11.5 pttt -139.48 122.44 16.69 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 113.191 -1.822 . . . . 0.0 108.497 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -19.43 64.95 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 129.931 3.292 . . . . 0.0 118.29 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 158.87 -12.49 0.21 Allowed Glycine 0 CA--C 1.528 0.858 0 CA-C-N 112.452 -2.158 . . . . 0.0 114.622 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -50.48 147.56 4.42 Favored 'General case' 0 C--N 1.36 1.041 0 CA-C-O 122.52 1.153 . . . . 0.0 113.414 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 70.1 mt -97.35 108.55 21.78 Favored 'Isoleucine or valine' 0 C--N 1.35 0.605 0 N-CA-C 101.618 -3.475 . . . . 0.0 101.618 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.22 157.29 18.46 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 111.683 -2.508 . . . . 0.0 111.57 -176.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -106.9 103.82 13.34 Favored 'General case' 0 C--O 1.215 -0.717 0 CA-C-N 110.508 -3.042 . . . . 0.0 109.639 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.3 t -85.52 113.15 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 C-N-CA 116.71 -1.996 . . . . 0.0 106.663 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 tp . . . . . 0 CA--C 1.553 1.08 0 CA-C-N 112.712 -2.04 . . . . 0.0 107.702 179.352 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 . . . . . 0 CA--C 1.545 0.764 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -136.25 155.76 49.64 Favored 'General case' 0 C--N 1.351 0.673 0 O-C-N 124.15 0.906 . . . . 0.0 108.57 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -136.29 149.7 48.56 Favored 'General case' 0 C--N 1.351 0.663 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 176.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -98.25 120.6 38.93 Favored 'General case' 0 C--N 1.347 0.487 0 N-CA-C 102.101 -3.296 . . . . 0.0 102.101 177.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.99 172.61 12.6 Favored 'General case' 0 C--N 1.348 0.524 0 C-N-CA 118.074 -1.45 . . . . 0.0 112.062 -175.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -125.6 142.04 51.71 Favored 'General case' 0 C--N 1.356 0.861 0 CA-C-N 112.532 -2.122 . . . . 0.0 112.104 -177.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 mt -158.88 125.17 4.56 Favored 'General case' 0 C--O 1.222 -0.371 1 CA-C-N 108.337 -4.029 . . . . 0.0 115.041 -179.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.341 0.0 OUTLIER 61.06 28.98 18.67 Favored 'General case' 0 C--N 1.358 0.943 0 N-CA-C 119.557 3.169 . . . . 0.0 119.557 171.18 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 68.67 22.97 75.53 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 119.694 -1.241 . . . . 0.0 111.909 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -131.08 142.37 50.27 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 111.126 -2.537 . . . . 0.0 105.37 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -139.67 140.7 36.95 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 113.31 -1.768 . . . . 0.0 107.589 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -177.19 176.84 48.23 Favored Glycine 0 C--N 1.346 1.089 0 C-N-CA 118.651 -1.738 . . . . 0.0 111.901 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -77.92 141.99 38.69 Favored 'General case' 0 C--N 1.35 0.606 0 CA-C-N 112.732 -1.734 . . . . 0.0 109.057 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 22.9 pt -142.12 148.17 47.2 Favored Pre-proline 0 N--CA 1.45 -0.454 0 CA-C-N 110.903 -2.862 . . . . 0.0 106.033 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -77.68 138.29 16.93 Favored 'Trans proline' 0 C--N 1.363 1.337 0 N-CA-C 114.066 0.756 . . . . 0.0 114.066 -177.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -33.51 71.89 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 117.315 -1.754 . . . . 0.0 112.549 -177.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.32 0.6 OUTLIER -70.01 -8.45 49.22 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 116.833 -1.947 . . . . 0.0 114.133 179.092 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -93.01 -13.19 29.01 Favored 'General case' 0 CA--C 1.559 1.308 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 176.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.491 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -128.88 170.62 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 CA-C-O 122.572 1.177 . . . . 0.0 109.736 179.606 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.491 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 2.8 tp10 -123.66 145.19 49.14 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 103.732 -2.692 . . . . 0.0 103.732 176.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . 0.275 38.5 mtm . . . . . 0 C--N 1.342 0.266 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -176.279 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo . . . . . 0 CA--C 1.554 1.495 0 N-CA-C 114.204 0.809 . . . . 0.0 114.204 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -54.71 160.94 6.63 Favored 'Trans proline' 0 C--N 1.368 1.575 0 C-N-CA 123.358 2.705 . . . . 0.0 116.997 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -73.51 127.93 12.23 Favored 'Trans proline' 0 C--N 1.371 1.757 0 N-CA-C 105.561 -2.515 . . . . 0.0 105.561 174.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.441 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 2.7 t -73.19 147.22 87.79 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-N 114.026 -1.443 . . . . 0.0 108.868 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' PRO . . . . . 0.441 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 13.4 Cg_exo -67.49 156.29 66.73 Favored 'Trans proline' 0 N--CA 1.45 -1.073 0 N-CA-C 115.69 1.381 . . . . 0.0 115.69 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -65.78 123.1 10.88 Favored 'Trans proline' 0 C--N 1.365 1.438 0 N-CA-C 107.347 -1.828 . . . . 0.0 107.347 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.848 0 CA-C-O 122.989 1.376 . . . . 0.0 110.831 -177.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.824 0 CA-C-O 123.057 1.408 . . . . 0.0 108.323 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.251 44.3 mt -146.99 115.49 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.848 0 CA-C-N 109.931 -3.304 . . . . 0.0 109.423 -176.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.57 125.16 25.65 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 176.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.2 mtmt -95.45 -23.56 17.07 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 114.591 -1.186 . . . . 0.0 113.635 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -140.75 169.06 18.34 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 107.057 -1.46 . . . . 0.0 107.057 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -68.94 150.79 47.32 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.89 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -147.64 130.65 16.27 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 116.712 -1.995 . . . . 0.0 109.476 175.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.07 103.2 8.15 Favored 'General case' 0 CA--C 1.556 1.198 0 N-CA-C 106.088 -1.819 . . . . 0.0 106.088 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.82 154.38 0.33 Allowed 'General case' 0 C--N 1.375 1.696 0 O-C-N 124.717 1.261 . . . . 0.0 113.787 -178.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.0 p -111.66 -15.52 13.43 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-N 111.772 -2.467 . . . . 0.0 112.167 -177.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.42 163.12 40.16 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 123.123 1.439 . . . . 0.0 110.052 -178.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -51.71 -34.24 37.93 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 110.733 -2.94 . . . . 0.0 115.263 -176.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -89.1 0.1 56.99 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 118.383 -1.327 . . . . 0.0 114.501 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.06 159.5 16.25 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 113.013 -1.903 . . . . 0.0 106.236 176.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -136.68 155.41 49.91 Favored 'General case' 0 CA--C 1.562 1.428 0 C-N-CA 118.303 -1.359 . . . . 0.0 108.049 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.8 m -83.67 163.78 20.08 Favored 'General case' 0 CA--C 1.568 1.645 0 CA-C-N 113.419 -1.719 . . . . 0.0 113.021 -177.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -164.71 172.7 12.73 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 111.074 -2.785 . . . . 0.0 107.457 173.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -132.65 151.64 51.9 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 104.621 -2.363 . . . . 0.0 104.621 178.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.5 ttp180 -46.89 104.48 0.05 Allowed 'General case' 0 CA--C 1.556 1.173 0 CA-C-N 112.994 -1.912 . . . . 0.0 112.381 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.32 -23.22 4.61 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-N 113.446 -1.706 . . . . 0.0 115.743 178.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -48.57 147.65 2.4 Favored 'General case' 0 C--N 1.364 1.239 0 N-CA-C 116.274 1.953 . . . . 0.0 116.274 -177.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.2 mp -100.87 117.05 45.55 Favored 'Isoleucine or valine' 0 C--N 1.346 0.416 0 CA-C-N 111.772 -2.467 . . . . 0.0 104.922 176.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.6 mp -110.67 159.88 17.19 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 122.748 1.261 . . . . 0.0 112.707 -179.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.0 108.14 19.2 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-N 110.78 -2.918 . . . . 0.0 105.633 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.7 t -87.13 102.3 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 111.827 -3.949 . . . . 0.0 110.147 -174.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.9 tt . . . . . 0 CA--C 1.539 0.557 0 C-N-CA 117.4 -1.72 . . . . 0.0 106.904 -179.934 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 . . . . . 0 C--O 1.219 -0.55 0 CA-C-O 118.593 -0.718 . . . . 0.0 112.845 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -123.38 152.87 41.1 Favored 'General case' 0 CA--C 1.553 1.074 0 O-C-N 124.338 1.024 . . . . 0.0 109.389 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -134.21 144.64 48.57 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 104.992 -2.225 . . . . 0.0 104.992 177.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -101.18 124.7 47.29 Favored 'General case' 0 C--N 1.358 0.948 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 178.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -144.34 169.14 18.49 Favored 'General case' 0 C--N 1.357 0.911 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -109.6 136.16 49.42 Favored 'General case' 0 C--N 1.367 1.342 0 CA-C-N 113.79 -1.55 . . . . 0.0 111.338 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.304 11.2 mt -162.49 139.76 8.12 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 110.297 -3.138 . . . . 0.0 113.577 177.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 58.39 28.94 17.52 Favored 'General case' 0 C--N 1.353 0.737 0 CA-C-N 110.829 -2.896 . . . . 0.0 115.48 169.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.07 18.19 78.87 Favored Glycine 0 CA--C 1.541 1.698 0 CA-C-N 114.647 -1.16 . . . . 0.0 114.199 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -137.37 166.56 23.52 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 124.593 1.157 . . . . 0.0 107.937 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -142.68 136.49 29.09 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 112.33 -2.214 . . . . 0.0 106.423 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -174.14 175.36 46.6 Favored Glycine 0 C--N 1.347 1.154 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.144 -178.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -78.78 147.83 33.17 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 122.927 1.346 . . . . 0.0 110.25 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.0 pt -142.16 147.85 45.72 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-N 111.54 -2.573 . . . . 0.0 106.162 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -75.41 142.43 26.64 Favored 'Trans proline' 0 C--N 1.362 1.275 0 N-CA-C 114.498 0.922 . . . . 0.0 114.498 -177.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.484 ' HZ1' ' HB2' ' A' ' 50' ' ' LYS . 0.0 OUTLIER -70.53 -30.92 67.79 Favored 'General case' 0 C--N 1.369 1.425 0 C-N-CA 113.345 -3.342 . . . . 0.0 113.493 -179.719 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -69.49 -9.54 54.2 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 116.161 -2.216 . . . . 0.0 114.726 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -93.04 -12.0 31.67 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.346 178.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.482 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -128.62 171.66 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 178.359 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.482 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 85.5 tt0 -132.19 132.96 43.65 Favored 'General case' 0 C--N 1.355 0.817 0 CA-C-N 112.53 -2.123 . . . . 0.0 106.16 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.6 mpp? . . . . . 0 CA--C 1.537 0.467 0 CA-C-N 113.369 -1.741 . . . . 0.0 110.004 179.782 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo . . . . . 0 N--CA 1.431 -2.156 0 N-CA-C 115.402 1.27 . . . . 0.0 115.402 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -54.81 156.75 14.3 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.663 2.242 . . . . 0.0 117.03 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -69.54 123.45 10.18 Favored 'Trans proline' 0 C--N 1.365 1.407 0 N-CA-C 105.345 -2.598 . . . . 0.0 105.345 174.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.439 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 3.3 t -72.05 150.39 92.47 Favored Pre-proline 0 C--N 1.343 0.296 0 CA-C-N 113.619 -1.628 . . . . 0.0 108.665 -178.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' PRO . . . . . 0.439 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 19.5 Cg_exo -69.99 155.87 64.13 Favored 'Trans proline' 0 N--CA 1.445 -1.328 0 O-C-N 123.473 1.249 . . . . 0.0 112.297 176.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -72.52 118.29 5.52 Favored 'Trans proline' 0 CA--C 1.547 1.16 0 N-CA-C 107.253 -1.864 . . . . 0.0 107.253 175.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.351 0.659 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 178.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.44 ' CB ' HD12 ' A' ' 53' ' ' ILE . . . . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 122.459 1.123 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.428 12.0 mt -149.61 130.81 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 111.336 -2.665 . . . . 0.0 111.949 -167.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.432 ' HA ' ' HB ' ' A' ' 53' ' ' ILE . . . -65.84 126.3 28.08 Favored 'General case' 0 CA--C 1.556 1.174 0 CA-C-N 113.589 -1.641 . . . . 0.0 108.742 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mmpt? -98.02 -28.03 13.96 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 114.047 -1.433 . . . . 0.0 114.155 -178.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -141.38 166.05 25.82 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 106.168 -1.79 . . . . 0.0 106.168 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.88 147.8 52.76 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 124.338 1.024 . . . . 0.0 109.451 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -146.69 132.78 19.28 Favored 'General case' 0 C--N 1.354 0.798 0 C-N-CA 118.043 -1.463 . . . . 0.0 109.471 176.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.9 mmtm -122.29 113.07 18.92 Favored 'General case' 0 C--N 1.346 0.431 0 CA-C-N 113.712 -1.585 . . . . 0.0 107.603 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.03 149.98 0.84 Allowed 'General case' 0 C--N 1.359 1.01 0 O-C-N 125.639 1.837 . . . . 0.0 112.468 -177.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.4 p -113.68 -19.4 11.59 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 111.054 -2.794 . . . . 0.0 113.557 -177.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.81 167.79 27.87 Favored 'General case' 0 C--N 1.354 0.777 0 CA-C-O 123.776 1.751 . . . . 0.0 111.965 -178.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -43.02 -39.67 2.75 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 109.824 -3.353 . . . . 0.0 115.393 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 49.2 p-10 -87.74 -0.81 57.41 Favored 'General case' 0 C--N 1.349 0.573 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 -175.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -106.39 159.77 15.89 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.714 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.06 150.5 50.44 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 112.017 -2.356 . . . . 0.0 106.213 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.2 m -84.07 169.1 15.26 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 123.709 1.718 . . . . 0.0 113.721 -177.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -162.69 178.99 8.02 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-N 111.712 -2.495 . . . . 0.0 108.377 171.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.49 ' HZ3' HD22 ' A' ' 42' ' ' ASN . 2.3 mtmt -139.33 135.18 33.5 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 103.836 -2.653 . . . . 0.0 103.836 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -42.28 97.95 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.779 0 O-C-N 125.555 1.784 . . . . 0.0 113.489 -177.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 138.31 -22.81 3.04 Favored Glycine 0 C--N 1.35 1.344 0 CA-C-N 113.209 -1.814 . . . . 0.0 115.33 178.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -47.02 143.3 3.08 Favored 'General case' 0 C--N 1.364 1.214 0 CA-C-O 121.547 0.689 . . . . 0.0 112.049 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mt -96.87 124.96 49.95 Favored 'Isoleucine or valine' 0 C--N 1.35 0.611 0 N-CA-C 103.498 -2.778 . . . . 0.0 103.498 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -111.07 157.8 19.57 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 125.201 1.563 . . . . 0.0 111.711 -175.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -118.99 103.26 9.41 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 128.74 3.775 . . . . 0.0 108.605 176.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.5 t -85.19 103.33 12.17 Favored 'Isoleucine or valine' 0 C--N 1.353 0.759 0 C-N-CA 116.139 -2.224 . . . . 0.0 109.744 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.355 0.806 0 CA-C-N 112.826 -1.988 . . . . 0.0 105.89 177.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 . . . . . 0 N--CA 1.444 -0.729 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 55.6 m95 -135.85 164.01 28.91 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -178.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -137.47 145.9 43.63 Favored 'General case' 0 C--N 1.358 0.936 0 O-C-N 124.392 1.058 . . . . 0.0 109.198 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.46 ' CB ' ' HZ1' ' A' ' 38' ' ' LYS . 0.5 OUTLIER -101.73 115.23 30.08 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 176.453 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.75 172.12 13.24 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 118.936 -1.106 . . . . 0.0 112.225 -176.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -108.79 130.35 55.39 Favored 'General case' 0 C--N 1.357 0.902 0 CA-C-N 113.566 -1.652 . . . . 0.0 111.789 -178.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.274 13.6 mt -163.15 146.29 10.57 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-N 110.409 -3.087 . . . . 0.0 115.501 178.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.49 HD22 ' HZ3' ' A' ' 20' ' ' LYS . 0.7 OUTLIER 57.35 29.03 16.19 Favored 'General case' 0 C--N 1.358 0.969 0 CA-C-N 111.374 -2.648 . . . . 0.0 114.929 169.299 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 71.83 21.15 79.03 Favored Glycine 0 CA--C 1.542 1.757 0 O-C-N 124.433 1.083 . . . . 0.0 114.679 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -138.16 169.59 17.52 Favored 'General case' 0 C--N 1.35 0.606 0 C-N-CA 125.532 1.533 . . . . 0.0 108.45 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -142.27 131.19 22.99 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 112.439 -2.164 . . . . 0.0 105.921 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -174.91 -179.22 45.35 Favored Glycine 0 C--N 1.344 1.023 0 C-N-CA 118.091 -2.004 . . . . 0.0 112.787 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -78.17 145.04 35.86 Favored 'General case' 0 C--N 1.353 0.734 0 CA-C-N 113.445 -1.378 . . . . 0.0 111.475 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 27.0 pt -144.86 148.13 37.9 Favored Pre-proline 0 C--N 1.351 0.634 0 CA-C-N 112.362 -2.199 . . . . 0.0 108.465 178.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -78.42 140.74 17.38 Favored 'Trans proline' 0 C--N 1.366 1.498 0 CA-C-N 119.472 0.847 . . . . 0.0 114.289 -179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.3 ptmm? -70.54 -35.57 73.2 Favored 'General case' 0 C--N 1.362 1.125 0 C-N-CA 116.344 -2.142 . . . . 0.0 113.106 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.268 0.7 OUTLIER -66.76 -9.86 41.2 Favored 'General case' 0 C--N 1.364 1.209 0 C-N-CA 114.276 -2.969 . . . . 0.0 114.57 -179.525 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -92.45 -12.6 31.66 Favored 'General case' 0 C--N 1.359 0.983 0 CA-C-O 117.446 -1.264 . . . . 0.0 111.589 178.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.44 HD12 ' CB ' ' A' ' 3' ' ' ALA . 0.0 OUTLIER -135.52 155.12 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 CA-C-N 119.07 0.85 . . . . 0.0 110.466 178.045 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -115.46 146.62 41.48 Favored 'General case' 0 C--N 1.361 1.069 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.346 0.438 0 CA-C-N 113.157 -1.838 . . . . 0.0 111.91 -178.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo . . . . . 0 CA--C 1.551 1.331 0 CA-C-O 122.164 0.818 . . . . 0.0 114.155 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -54.18 158.71 8.92 Favored 'Trans proline' 0 C--N 1.358 1.07 0 N-CA-C 117.1 1.923 . . . . 0.0 117.1 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_endo -70.65 123.3 9.68 Favored 'Trans proline' 0 C--N 1.36 1.163 0 N-CA-C 104.91 -2.765 . . . . 0.0 104.91 173.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.477 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.3 t -63.81 148.39 94.72 Favored Pre-proline 0 C--N 1.35 0.625 0 O-C-N 124.84 1.338 . . . . 0.0 109.205 -178.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' PRO . . . . . 0.477 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 23.2 Cg_exo -62.61 153.48 71.46 Favored 'Trans proline' 0 N--CA 1.447 -1.221 0 O-C-N 122.93 0.963 . . . . 0.0 114.253 178.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -69.62 112.8 3.15 Favored 'Trans proline' 0 C--N 1.363 1.338 0 N-CA-C 106.648 -2.097 . . . . 0.0 106.648 176.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.343 0.303 0 CA-C-N 113.009 -1.905 . . . . 0.0 106.702 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.398 0 CA-C-O 123.326 1.536 . . . . 0.0 113.881 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.407 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 2.0 mt -157.42 -177.3 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 100.425 -3.917 . . . . 0.0 100.425 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -165.82 108.87 0.79 Allowed 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 102.389 -3.189 . . . . 0.0 102.389 177.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.9 mtmp? -90.01 -15.19 32.39 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 111.122 -2.763 . . . . 0.0 116.504 -175.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -142.35 164.79 29.19 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -71.37 152.88 42.75 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 117.17 -1.812 . . . . 0.0 108.419 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -142.68 142.69 32.08 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.5 tptt -134.83 103.79 5.75 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 112.548 -2.115 . . . . 0.0 108.164 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.25 158.6 0.1 Allowed 'General case' 0 N--CA 1.482 1.15 0 CA-C-O 122.944 1.354 . . . . 0.0 114.199 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.0 p -119.09 -15.28 9.26 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 110.335 -3.121 . . . . 0.0 112.669 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.16 170.08 21.4 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-O 123.316 1.531 . . . . 0.0 113.366 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -50.63 -34.79 27.56 Favored 'General case' 0 CA--C 1.555 1.159 0 CA-C-N 109.948 -3.296 . . . . 0.0 114.337 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -92.19 -5.0 53.38 Favored 'General case' 0 C--N 1.355 0.828 0 N-CA-C 115.551 1.686 . . . . 0.0 115.551 -176.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -108.86 156.5 19.59 Favored 'General case' 0 C--O 1.222 -0.377 0 O-C-N 124.826 1.329 . . . . 0.0 108.936 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . 0.265 2.9 pp -137.79 156.04 48.38 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 112.718 -2.037 . . . . 0.0 111.121 177.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 m -84.42 170.54 13.45 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 111.913 -2.403 . . . . 0.0 115.484 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -163.53 175.56 10.58 Favored 'General case' 0 C--N 1.352 0.699 0 CA-C-N 109.461 -3.518 . . . . 0.0 107.586 175.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mtmt -136.53 143.18 43.58 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 112.777 -2.01 . . . . 0.0 106.388 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -44.08 98.05 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.28 0 O-C-N 126.247 2.217 . . . . 0.0 112.957 -178.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 140.34 -23.24 2.71 Favored Glycine 0 CA--C 1.543 1.81 0 CA-C-N 113.428 -1.714 . . . . 0.0 114.992 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -51.22 145.84 7.48 Favored 'General case' 0 C--N 1.363 1.154 0 N-CA-C 116.099 1.888 . . . . 0.0 116.099 -176.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -104.34 112.77 39.24 Favored 'Isoleucine or valine' 0 C--N 1.346 0.456 0 N-CA-C 102.188 -3.264 . . . . 0.0 102.188 173.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.3 mp -104.95 167.76 9.5 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 116.146 -2.222 . . . . 0.0 112.923 -176.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.72 109.15 20.97 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 176.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 71.1 t -87.78 97.02 6.19 Favored 'Isoleucine or valine' 0 C--N 1.357 0.927 0 C-N-CA 114.888 -2.725 . . . . 0.0 107.874 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.446 -0.631 0 CA-C-N 111.955 -2.384 . . . . 0.0 107.484 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.4 m120 . . . . . 0 CA--C 1.566 1.589 0 CA-C-O 119.22 -0.419 . . . . 0.0 109.913 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.5 m95 -136.49 161.31 36.21 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.776 0.798 . . . . 0.0 110.85 -177.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -133.71 150.92 51.52 Favored 'General case' 0 C--N 1.355 0.819 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.7 tttt -102.68 119.16 38.35 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 176.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.0 170.11 16.34 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 118.273 -1.371 . . . . 0.0 113.401 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -110.57 138.55 46.82 Favored 'General case' 0 C--N 1.362 1.116 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.64 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.281 12.1 mt -160.02 138.24 10.19 Favored 'General case' 0 CA--C 1.502 -0.88 0 CA-C-N 112.709 -2.041 . . . . 0.0 112.977 179.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 56.92 21.9 6.62 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 116.191 -2.203 . . . . 0.0 115.658 168.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 92.51 -9.06 76.58 Favored Glycine 0 CA--C 1.546 1.988 0 N-CA-C 115.37 0.908 . . . . 0.0 115.37 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.9 mttp -113.25 170.05 8.5 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -140.94 131.17 24.92 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 113.119 -1.855 . . . . 0.0 106.303 -179.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.96 173.37 45.57 Favored Glycine 0 C--N 1.349 1.267 0 C-N-CA 116.401 -2.809 . . . . 0.0 113.217 -177.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -76.77 139.34 40.37 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 123.653 1.692 . . . . 0.0 109.511 -179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -139.99 143.1 32.93 Favored Pre-proline 0 C--N 1.347 0.498 0 CA-C-N 110.8 -2.909 . . . . 0.0 106.462 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -74.76 143.75 30.31 Favored 'Trans proline' 0 C--N 1.361 1.216 0 N-CA-C 115.07 1.142 . . . . 0.0 115.07 -175.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 15.6 pttt -71.9 -33.85 68.65 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 116.072 -2.251 . . . . 0.0 113.947 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -62.11 -19.66 63.23 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-N 115.077 -0.965 . . . . 0.0 113.144 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -93.35 -13.34 28.22 Favored 'General case' 0 CA--C 1.566 1.591 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.494 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -126.86 173.25 12.79 Favored 'Isoleucine or valine' 0 C--N 1.368 1.401 0 CA-C-O 121.808 0.813 . . . . 0.0 111.115 -178.338 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.494 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 0.2 OUTLIER -131.41 137.15 48.55 Favored 'General case' 0 C--N 1.358 0.971 0 CA-C-N 112.691 -2.05 . . . . 0.0 107.494 178.163 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 62.2 mtm . . . . . 0 C--N 1.343 0.301 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.239 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo . . . . . 0 CA--C 1.573 2.431 0 N-CA-C 116.069 1.527 . . . . 0.0 116.069 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -52.6 156.35 8.87 Favored 'Trans proline' 0 C--N 1.373 1.831 0 C-N-CA 123.953 3.102 . . . . 0.0 116.785 178.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -74.67 120.34 6.12 Favored 'Trans proline' 0 C--N 1.358 1.037 0 N-CA-C 106.287 -2.236 . . . . 0.0 106.287 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 2.5 t -66.02 149.95 97.14 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-N 113.555 -1.657 . . . . 0.0 109.908 -178.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -71.26 159.95 50.35 Favored 'Trans proline' 0 C--N 1.359 1.099 0 N-CA-C 116.749 1.788 . . . . 0.0 116.749 178.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -75.94 118.69 5.11 Favored 'Trans proline' 0 C--N 1.359 1.098 0 N-CA-C 107.157 -1.901 . . . . 0.0 107.157 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.416 ' H ' ' NE ' ' B' ' 8' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.345 0.378 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 178.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.716 0 CA-C-O 122.361 1.077 . . . . 0.0 109.648 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.44 ' H ' HG13 ' A' ' 53' ' ' ILE . 11.1 mt -156.63 110.02 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.806 0 CA-C-N 111.286 -2.688 . . . . 0.0 109.408 -176.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.17 122.13 17.64 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 116.073 -2.251 . . . . 0.0 109.375 178.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -96.16 -23.01 16.94 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -179.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -140.01 160.57 39.64 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.2 151.22 47.93 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.042 -1.435 . . . . 0.0 109.561 -178.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -143.77 139.3 29.33 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 176.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? -126.45 96.88 4.83 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-N 111.964 -2.38 . . . . 0.0 109.677 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -45.22 149.51 0.5 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 122.192 0.996 . . . . 0.0 113.387 -178.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.8 t -123.92 2.32 8.72 Favored 'General case' 0 C--N 1.354 0.772 0 CA-C-N 111.309 -2.678 . . . . 0.0 114.855 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.4 163.84 39.21 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 118.399 -1.32 . . . . 0.0 110.363 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -50.6 -39.17 49.23 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-N 111.609 -2.541 . . . . 0.0 113.264 -178.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.6 p30 -88.9 1.07 55.97 Favored 'General case' 0 C--N 1.354 0.778 0 N-CA-C 116.421 2.008 . . . . 0.0 116.421 -176.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -113.66 153.14 29.42 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 124.633 1.208 . . . . 0.0 109.382 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -136.39 158.76 43.66 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 113.47 -1.695 . . . . 0.0 110.793 178.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.7 m -84.2 170.83 13.36 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 116.933 2.197 . . . . 0.0 116.933 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -163.83 170.55 16.7 Favored 'General case' 0 C--N 1.355 0.824 0 CA-C-N 109.07 -3.695 . . . . 0.0 109.863 176.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -135.45 118.29 16.2 Favored 'General case' 0 C--N 1.354 0.787 0 CA-C-N 112.57 -2.105 . . . . 0.0 110.57 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -14.51 74.48 0.0 OUTLIER 'General case' 0 CA--C 1.559 1.291 0 N-CA-C 116.837 2.162 . . . . 0.0 116.837 178.149 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 150.78 -16.74 0.94 Allowed Glycine 0 CA--C 1.537 1.427 0 CA-C-N 111.847 -2.433 . . . . 0.0 116.0 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.96 151.59 2.5 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -178.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.3 pt -98.71 108.68 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.393 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.0 mp -104.75 157.36 17.25 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 116.443 -2.103 . . . . 0.0 110.804 -177.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -105.0 106.54 17.07 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 110.922 -2.854 . . . . 0.0 108.026 177.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 86.6 t -86.7 111.08 21.01 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 C-N-CA 115.216 -2.594 . . . . 0.0 106.099 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 tm? . . . . . 0 C--N 1.352 0.708 0 CA-C-N 112.592 -2.095 . . . . 0.0 113.844 -176.466 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 22.3 m-20 . . . . . 0 CA--C 1.562 1.441 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.565 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -135.39 169.58 17.27 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 122.357 1.075 . . . . 0.0 109.66 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -137.97 139.62 39.8 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 113.235 -1.802 . . . . 0.0 106.715 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -98.76 115.52 28.94 Favored 'General case' 0 C--N 1.354 0.772 0 N-CA-C 100.393 -3.928 . . . . 0.0 100.393 176.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.49 176.23 8.89 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 125.044 1.465 . . . . 0.0 113.417 -173.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -120.02 148.32 43.71 Favored 'General case' 0 C--N 1.362 1.12 0 O-C-N 125.064 1.478 . . . . 0.0 111.118 -179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.302 9.4 mt -161.94 138.93 8.33 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-N 110.465 -3.061 . . . . 0.0 111.953 179.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.63 29.06 12.92 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 115.688 -2.405 . . . . 0.0 116.43 168.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.94 10.63 85.42 Favored Glycine 0 CA--C 1.546 2.019 0 C-N-CA 118.662 -1.732 . . . . 0.0 115.013 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -135.73 163.01 31.15 Favored 'General case' 0 C--O 1.217 -0.629 0 C-N-CA 124.597 1.159 . . . . 0.0 107.942 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -141.41 139.73 33.51 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.419 -178.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -170.96 176.09 44.46 Favored Glycine 0 C--N 1.347 1.161 0 C-N-CA 118.477 -1.82 . . . . 0.0 110.591 -177.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -77.3 144.8 37.83 Favored 'General case' 0 C--N 1.354 0.801 0 CA-C-O 122.522 1.153 . . . . 0.0 110.708 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.3 pt -144.42 139.29 15.48 Favored Pre-proline 0 C--N 1.352 0.677 0 CA-C-N 112.392 -2.185 . . . . 0.0 107.819 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -72.02 148.66 51.38 Favored 'Trans proline' 0 C--N 1.363 1.336 0 CA-C-N 120.018 1.042 . . . . 0.0 114.197 -176.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -70.22 -41.69 73.29 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 115.136 -2.626 . . . . 0.0 111.395 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.1 p-10 -57.46 -18.68 19.65 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 -179.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -91.63 -7.81 48.98 Favored 'General case' 0 C--N 1.355 0.843 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.44 HG13 ' H ' ' A' ' 4' ' ' ILE . 0.1 OUTLIER -129.83 172.8 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.1 0 CA-C-O 122.184 0.992 . . . . 0.0 108.759 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.438 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 21.7 tt0 -129.47 131.74 46.76 Favored 'General case' 0 C--N 1.349 0.568 0 N-CA-C 104.756 -2.312 . . . . 0.0 104.756 176.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.5 mpp? . . . . . 0 CA--C 1.518 -0.268 0 CA-C-N 113.556 -1.656 . . . . 0.0 110.599 178.027 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo . . . . . 0 CA--C 1.579 2.73 0 N-CA-C 116.01 1.504 . . . . 0.0 116.01 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -58.7 161.07 15.79 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 123.594 2.863 . . . . 0.0 118.297 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -71.45 117.92 5.4 Favored 'Trans proline' 0 C--N 1.37 1.69 0 N-CA-C 105.498 -2.539 . . . . 0.0 105.498 174.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.4 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.1 t -65.56 147.34 98.73 Favored Pre-proline 0 CA--C 1.551 0.997 0 CA-C-N 113.685 -1.598 . . . . 0.0 109.135 -178.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' PRO . . . . . 0.4 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 2.8 Cg_exo -68.1 159.64 52.19 Favored 'Trans proline' 0 C--N 1.363 1.329 0 N-CA-C 116.805 1.81 . . . . 0.0 116.805 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -76.28 119.81 5.42 Favored 'Trans proline' 0 CA--C 1.553 1.443 0 N-CA-C 107.785 -1.659 . . . . 0.0 107.785 175.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.362 1.118 0 C-N-CA 118.495 -1.282 . . . . 0.0 109.879 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.563 0 N-CA-C 105.139 -2.171 . . . . 0.0 105.139 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.557 ' H ' HG12 ' A' ' 53' ' ' ILE . 22.7 mt -146.67 112.75 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 N-CA-C 104.924 -2.251 . . . . 0.0 104.924 -174.32 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 0.41 ' HA ' ' HB ' ' A' ' 53' ' ' ILE . . . -68.21 144.2 55.02 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-N 112.033 -2.349 . . . . 0.0 110.715 -178.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 mtmt -98.95 -28.04 13.61 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 128.21 2.604 . . . . 0.0 113.205 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -144.63 164.21 31.63 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 117.521 -1.672 . . . . 0.0 108.463 -179.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -64.53 143.57 57.82 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 113.398 -1.728 . . . . 0.0 107.876 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -142.46 142.67 32.35 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 122.857 1.313 . . . . 0.0 107.902 177.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.25 115.55 16.47 Favored 'General case' 0 CA--C 1.56 1.332 0 CA-C-N 111.632 -2.531 . . . . 0.0 109.687 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.35 147.93 2.13 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.372 0.606 . . . . 0.0 112.435 -177.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.7 p -121.96 -5.52 9.03 Favored 'General case' 0 C--N 1.353 0.74 0 CA-C-N 113.449 -1.705 . . . . 0.0 112.602 -178.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.55 165.34 34.55 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-O 123.34 1.543 . . . . 0.0 110.287 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -50.67 -35.99 33.57 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 110.28 -3.145 . . . . 0.0 115.453 -178.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 52.4 p-10 -93.23 0.9 57.22 Favored 'General case' 0 C--N 1.352 0.684 0 O-C-N 124.444 1.09 . . . . 0.0 113.811 -176.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -109.81 160.81 16.03 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 114.152 -1.385 . . . . 0.0 109.71 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.8 161.09 36.56 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-N 113.754 -1.566 . . . . 0.0 110.109 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.0 m -84.87 163.74 18.83 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 113.676 -1.602 . . . . 0.0 115.186 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 50.9 p90 -164.41 160.46 20.7 Favored 'General case' 0 C--N 1.359 0.991 0 CA-C-N 110.85 -2.886 . . . . 0.0 109.788 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.36 119.36 16.42 Favored 'General case' 0 C--N 1.348 0.542 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.671 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -4.04 92.58 0.01 OUTLIER 'General case' 0 C--N 1.363 1.154 0 C-N-CA 127.185 2.194 . . . . 0.0 114.23 -178.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 118.29 8.03 10.68 Favored Glycine 0 C--N 1.353 1.485 0 O-C-N 125.014 1.446 . . . . 0.0 116.252 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -62.28 152.95 32.15 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 117.372 -1.731 . . . . 0.0 112.936 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 83.6 mt -96.16 112.22 27.94 Favored 'Isoleucine or valine' 0 C--N 1.352 0.702 0 N-CA-C 104.895 -2.261 . . . . 0.0 104.895 178.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.93 145.79 29.62 Favored 'General case' 0 C--N 1.352 0.706 0 CA-C-N 113.302 -1.772 . . . . 0.0 111.037 -176.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.12 113.03 24.15 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-N 111.714 -2.494 . . . . 0.0 108.429 177.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 t -86.35 108.03 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 115.106 -2.638 . . . . 0.0 111.404 -174.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.4 tp . . . . . 0 C--N 1.351 0.641 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 -178.358 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 . . . . . 0 CA--C 1.548 0.882 0 CA-C-O 119.42 -0.324 . . . . 0.0 111.624 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.7 m95 -139.0 154.84 48.3 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-O 121.316 0.579 . . . . 0.0 110.373 -177.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -136.15 137.57 41.09 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 104.728 -2.323 . . . . 0.0 104.728 175.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -98.78 117.48 33.35 Favored 'General case' 0 C--N 1.353 0.723 0 N-CA-C 105.212 -2.144 . . . . 0.0 105.212 176.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.38 174.95 10.0 Favored 'General case' 0 C--N 1.352 0.68 0 O-C-N 124.346 1.029 . . . . 0.0 111.793 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.5 132.15 52.85 Favored 'General case' 0 C--N 1.359 1.018 0 O-C-N 124.482 1.114 . . . . 0.0 110.23 -178.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.257 9.8 mt -159.84 145.8 15.77 Favored 'General case' 0 C--N 1.36 1.025 0 CA-C-N 111.482 -2.599 . . . . 0.0 114.736 178.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.26 28.27 13.03 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 110.723 -2.944 . . . . 0.0 115.011 170.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.9 11.54 82.53 Favored Glycine 0 CA--C 1.541 1.688 0 C-N-CA 119.612 -1.28 . . . . 0.0 114.509 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -138.51 -177.89 5.05 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-O 122.566 1.174 . . . . 0.0 110.225 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -141.93 133.07 26.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 112.232 -2.258 . . . . 0.0 105.556 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -173.05 173.65 45.68 Favored Glycine 0 C--N 1.338 0.688 0 C-N-CA 117.437 -2.316 . . . . 0.0 111.834 -178.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -77.73 146.61 35.83 Favored 'General case' 0 CA--C 1.56 1.356 0 CA-C-N 112.54 -1.83 . . . . 0.0 110.665 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.9 pt -143.79 144.75 28.16 Favored Pre-proline 0 C--N 1.352 0.711 0 CA-C-N 111.414 -2.63 . . . . 0.0 107.475 177.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -80.18 138.61 12.81 Favored 'Trans proline' 0 C--N 1.367 1.534 0 N-CA-C 114.808 1.042 . . . . 0.0 114.808 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.52 -35.06 70.58 Favored 'General case' 0 C--N 1.354 0.768 0 CA-C-O 117.009 -1.472 . . . . 0.0 113.009 -178.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.277 0.5 OUTLIER -63.03 -10.71 15.06 Favored 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 113.046 -3.462 . . . . 0.0 112.834 178.146 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -94.67 -15.08 24.25 Favored 'General case' 0 CA--C 1.555 1.159 0 CA-C-O 117.47 -1.253 . . . . 0.0 108.942 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.557 HG12 ' H ' ' A' ' 4' ' ' ILE . 0.0 OUTLIER -133.98 160.56 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-O 122.901 1.334 . . . . 0.0 111.111 178.481 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -126.9 145.01 50.83 Favored 'General case' 0 C--N 1.346 0.424 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 178.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 0.434 ' CE ' ' H ' ' A' ' 55' ' ' MET . 0.0 OUTLIER . . . . . 0 C--N 1.343 0.324 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.261 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo . . . . . 0 CA--C 1.571 2.331 0 N-CA-C 116.494 1.69 . . . . 0.0 116.494 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -50.6 160.18 1.83 Allowed 'Trans proline' 0 C--N 1.372 1.816 0 C-N-CA 124.499 3.466 . . . . 0.0 118.74 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -75.69 112.77 3.59 Favored 'Trans proline' 0 C--N 1.357 1.02 0 N-CA-C 106.621 -2.107 . . . . 0.0 106.621 176.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 3.5 t -58.26 143.61 79.08 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 113.256 -1.793 . . . . 0.0 109.824 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -61.2 150.31 85.16 Favored 'Trans proline' 0 C--N 1.359 1.117 0 O-C-N 122.789 0.889 . . . . 0.0 114.067 179.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_endo -67.68 111.78 2.46 Favored 'Trans proline' 0 C--N 1.364 1.391 0 N-CA-C 107.713 -1.687 . . . . 0.0 107.713 177.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.353 0.761 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 -178.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.276 0 CA-C-O 121.902 0.858 . . . . 0.0 109.132 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.1 mt -145.01 117.42 2.34 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 CA-C-N 112.647 -2.07 . . . . 0.0 109.762 -176.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.43 125.22 26.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 117.296 -1.762 . . . . 0.0 108.311 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.9 -24.95 16.18 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.521 -1.218 . . . . 0.0 114.139 -178.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -142.49 165.65 26.83 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -68.84 157.97 35.42 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 116.69 -2.004 . . . . 0.0 109.173 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -145.96 142.78 29.02 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 118.554 -1.258 . . . . 0.0 108.895 175.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -129.44 100.96 5.75 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 127.333 2.253 . . . . 0.0 108.993 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.844 ' H ' ' HG ' ' A' ' 18' ' ' SER . . . -44.93 160.26 0.04 OUTLIER 'General case' 0 C--N 1.352 0.696 0 CA-C-O 123.079 1.419 . . . . 0.0 113.862 -177.16 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 p -117.12 -25.63 7.08 Favored 'General case' 0 CA--C 1.557 1.247 0 CA-C-N 110.648 -2.978 . . . . 0.0 112.348 -178.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.73 168.15 26.63 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 117.096 -1.842 . . . . 0.0 110.628 -177.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -42.54 -40.58 2.7 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 109.949 -3.296 . . . . 0.0 114.352 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -85.83 0.86 51.87 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -177.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -112.13 155.84 23.26 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 178.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -136.63 155.58 49.71 Favored 'General case' 0 C--N 1.345 0.411 0 CA-C-N 113.371 -1.74 . . . . 0.0 108.422 178.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' SER . . . . . 0.844 ' HG ' ' H ' ' A' ' 11' ' ' ALA . 22.0 m -87.15 173.17 9.41 Favored 'General case' 0 CA--C 1.47 -2.125 0 N-CA-C 119.274 3.065 . . . . 0.0 119.274 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -162.88 -175.6 4.48 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 108.532 -3.94 . . . . 0.0 108.625 175.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.73 140.58 34.88 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 112.328 -2.214 . . . . 0.0 105.95 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.81 101.57 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.875 0 O-C-N 124.974 1.421 . . . . 0.0 111.63 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 136.3 -25.04 3.19 Favored Glycine 0 C--N 1.355 1.59 0 CA-C-N 113.96 -1.473 . . . . 0.0 114.232 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -58.38 145.86 36.81 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 117.036 -1.865 . . . . 0.0 112.8 -177.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.2 mm -97.58 113.95 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 103.398 -2.815 . . . . 0.0 103.398 178.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -100.96 162.78 12.65 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 116.241 -2.184 . . . . 0.0 109.697 -175.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -103.31 111.07 23.31 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 108.949 -3.751 . . . . 0.0 105.903 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 90.1 t -87.83 100.34 10.07 Favored 'Isoleucine or valine' 0 C--N 1.342 0.275 0 C-N-CA 116.391 -2.124 . . . . 0.0 111.259 -175.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 tm? . . . . . 0 C--N 1.349 0.579 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 177.484 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.6 m-20 . . . . . 0 CA--C 1.553 1.074 0 CA-C-O 118.275 -0.869 . . . . 0.0 113.004 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -136.39 161.01 37.02 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.997 0.903 . . . . 0.0 109.517 -177.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -131.91 145.1 51.31 Favored 'General case' 0 C--N 1.345 0.381 0 CA-C-N 112.926 -1.943 . . . . 0.0 106.4 178.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 38.8 tttm -101.65 121.27 41.71 Favored 'General case' 0 C--N 1.348 0.523 0 N-CA-C 105.852 -1.906 . . . . 0.0 105.852 177.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -142.29 176.4 9.02 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 118.719 -1.192 . . . . 0.0 113.464 -176.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -120.73 140.18 52.02 Favored 'General case' 0 C--O 1.203 -1.362 0 CA-C-O 123.608 1.67 . . . . 0.0 111.879 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.29 16.1 mt -162.14 154.66 19.65 Favored 'General case' 0 C--O 1.189 -2.109 0 CA-C-N 110.033 -3.258 . . . . 0.0 114.005 178.055 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 48.69 23.4 0.64 Allowed 'General case' 0 CA--C 1.555 1.163 0 O-C-N 127.163 2.79 . . . . 0.0 116.237 169.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.94 -5.43 85.13 Favored Glycine 0 CA--C 1.559 2.825 0 N-CA-C 116.439 1.336 . . . . 0.0 116.439 -178.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.9 mtmt -118.57 173.43 6.85 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 123.163 1.459 . . . . 0.0 107.811 177.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.0 p-10 -142.6 133.31 25.37 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 111.7 -2.5 . . . . 0.0 106.8 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -169.36 178.03 42.69 Favored Glycine 0 C--N 1.346 1.124 0 C-N-CA 117.091 -2.48 . . . . 0.0 111.344 -178.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -77.46 146.96 36.16 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 118.62 -1.232 . . . . 0.0 112.684 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 21.1 pt -142.29 137.74 15.93 Favored Pre-proline 0 C--N 1.359 0.999 0 CA-C-N 112.62 -2.082 . . . . 0.0 107.506 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -70.38 147.89 59.88 Favored 'Trans proline' 0 C--N 1.356 0.955 0 N-CA-C 114.339 0.861 . . . . 0.0 114.339 -176.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -71.11 -43.29 67.94 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 116.597 -2.041 . . . . 0.0 111.371 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -53.91 -23.99 14.63 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 178.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -89.54 -3.23 58.42 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 118.986 -1.086 . . . . 0.0 111.518 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.413 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -129.54 173.61 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.142 0 CA-C-N 119.64 1.109 . . . . 0.0 108.909 178.775 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.413 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 31.3 tt0 -129.81 121.03 25.98 Favored 'General case' 0 C--N 1.347 0.49 0 N-CA-C 103.487 -2.783 . . . . 0.0 103.487 178.148 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.345 0.373 0 CA-C-N 113.143 -1.844 . . . . 0.0 112.143 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . 0.258 3.4 Cg_exo . . . . . 0 N--CA 1.431 -2.195 0 N-CA-C 115.186 1.187 . . . . 0.0 115.186 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -45.91 155.52 0.56 Allowed 'Trans proline' 0 C--N 1.368 1.586 0 C-N-CA 123.127 2.551 . . . . 0.0 116.518 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -76.0 105.82 2.15 Favored 'Trans proline' 0 C--N 1.366 1.484 0 N-CA-C 106.256 -2.248 . . . . 0.0 106.256 178.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 4.2 t -50.36 146.13 9.37 Favored Pre-proline 0 CA--C 1.559 1.314 0 CA-C-N 113.492 -1.686 . . . . 0.0 110.639 -178.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.69 155.66 69.4 Favored 'Trans proline' 0 C--N 1.365 1.44 0 C-N-CA 120.937 1.091 . . . . 0.0 113.854 178.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -73.37 110.29 3.03 Favored 'Trans proline' 0 C--N 1.356 0.928 0 N-CA-C 106.164 -2.283 . . . . 0.0 106.164 176.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.505 0 C-N-CA 116.747 -1.981 . . . . 0.0 106.247 -179.448 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.2 mt -150.19 122.6 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.352 0.706 0 CA-C-N 113.239 -1.8 . . . . 0.0 109.784 -175.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.04 127.57 33.07 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 113.31 -1.768 . . . . 0.0 110.788 178.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.12 -24.14 18.37 Favored 'General case' 0 CA--C 1.558 1.274 0 CA-C-N 113.887 -1.506 . . . . 0.0 112.577 178.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -141.34 166.5 24.6 Favored 'General case' 0 C--N 1.355 0.836 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -68.86 156.21 38.84 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 116.689 -2.004 . . . . 0.0 108.176 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -146.24 138.82 25.39 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 174.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.407 ' O ' ' CD ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -129.39 103.24 6.8 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 106.506 -1.664 . . . . 0.0 106.506 177.266 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.96 157.62 0.15 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 122.954 1.359 . . . . 0.0 112.236 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -148.29 20.82 1.08 Allowed 'General case' 0 CA--C 1.565 1.548 0 CA-C-N 111.073 -2.785 . . . . 0.0 114.19 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.84 140.7 20.11 Favored 'General case' 0 C--N 1.348 0.527 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -43.08 -32.85 0.75 Allowed 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 114.131 -1.395 . . . . 0.0 114.048 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 53.8 p30 -92.54 -4.59 53.26 Favored 'General case' 0 CA--C 1.568 1.663 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 -178.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -107.34 154.74 20.84 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.89 0.852 . . . . 0.0 108.849 -178.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 pp -133.3 158.72 42.24 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 112.481 -2.145 . . . . 0.0 111.161 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.7 m -85.75 171.63 11.45 Favored 'General case' 0 C--N 1.35 0.601 0 N-CA-C 117.191 2.293 . . . . 0.0 117.191 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.4 p90 -164.36 166.53 20.67 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 109.827 -3.352 . . . . 0.0 109.115 174.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -134.96 111.72 10.05 Favored 'General case' 0 CA--C 1.557 1.236 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.367 178.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -3.88 93.23 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 127.516 2.326 . . . . 0.0 113.962 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 120.38 3.7 11.4 Favored Glycine 0 CA--C 1.547 2.034 0 CA-C-N 113.688 -1.596 . . . . 0.0 116.495 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -59.12 155.45 13.89 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-O 122.58 1.181 . . . . 0.0 113.196 -178.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 pt -96.93 103.92 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.319 0 CA-C-N 111.16 -2.745 . . . . 0.0 104.851 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -108.05 158.95 16.95 Favored 'General case' 0 C--N 1.349 0.587 0 CA-C-N 113.804 -1.543 . . . . 0.0 110.812 -176.181 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.73 109.64 14.49 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 112.295 -2.23 . . . . 0.0 107.192 177.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.8 m -85.88 114.98 26.49 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 C-N-CA 117.099 -1.84 . . . . 0.0 110.24 -176.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 tm? . . . . . 0 CA--C 1.544 0.716 0 CA-C-N 111.828 -2.442 . . . . 0.0 117.015 -179.972 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.2 m120 . . . . . 0 CA--C 1.55 0.95 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -139.96 168.47 19.73 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 121.535 0.684 . . . . 0.0 109.406 -176.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -140.87 150.1 42.8 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.396 -1.274 . . . . 0.0 107.841 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -103.99 117.95 35.51 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 105.397 -2.075 . . . . 0.0 105.397 176.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -140.5 176.62 8.63 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 123.982 0.801 . . . . 0.0 112.399 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -112.03 135.75 52.28 Favored 'General case' 0 C--N 1.364 1.21 0 O-C-N 123.89 0.743 . . . . 0.0 109.728 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 18.5 mt -160.36 143.67 13.64 Favored 'General case' 0 CA--C 1.468 -2.181 0 C-N-CA 126.864 2.066 . . . . 0.0 115.685 -178.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.25 32.31 18.33 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 115.358 -2.537 . . . . 0.0 115.967 168.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.1 -4.92 68.61 Favored Glycine 0 CA--C 1.558 2.774 0 C-N-CA 119.891 -1.147 . . . . 0.0 115.696 -178.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.0 -175.68 3.29 Favored 'General case' 0 C--N 1.352 0.705 0 CA-C-O 122.983 1.373 . . . . 0.0 109.505 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -142.48 134.25 26.9 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 111.61 -2.541 . . . . 0.0 104.789 178.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.45 175.5 45.59 Favored Glycine 0 C--N 1.35 1.317 0 C-N-CA 116.373 -2.822 . . . . 0.0 112.215 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -77.49 143.67 38.31 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 117.927 -1.509 . . . . 0.0 112.014 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 pt -142.57 144.59 30.98 Favored Pre-proline 0 C--N 1.356 0.865 0 CA-C-N 112.064 -2.335 . . . . 0.0 107.817 179.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -77.79 155.38 30.79 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 N-CA-C 118.471 2.451 . . . . 0.0 118.471 -177.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.7 mttt -68.61 -56.5 8.03 Favored 'General case' 0 C--N 1.36 1.042 0 CA-C-N 112.651 -2.068 . . . . 0.0 110.261 178.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.321 0.7 OUTLIER -59.19 -8.34 1.55 Allowed 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 115.28 -2.568 . . . . 0.0 115.683 -179.752 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -95.07 -11.54 28.13 Favored 'General case' 0 CA--C 1.567 1.622 0 CA-C-O 117.642 -1.17 . . . . 0.0 113.55 175.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.404 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -133.15 166.56 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 CA-C-N 120.368 1.44 . . . . 0.0 110.159 -178.915 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.404 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 8.3 tt0 -127.71 136.02 50.97 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 112.543 -2.117 . . . . 0.0 105.583 175.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 5.5 mtp . . . . . 0 CA--C 1.538 0.493 0 CA-C-N 114.04 -1.436 . . . . 0.0 108.885 179.0 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo . . . . . 0 N--CA 1.443 -1.47 0 N-CA-C 117.063 1.909 . . . . 0.0 117.063 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -50.58 159.13 2.33 Favored 'Trans proline' 0 C--N 1.369 1.614 0 C-N-CA 122.07 1.847 . . . . 0.0 115.141 177.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -71.07 119.47 6.33 Favored 'Trans proline' 0 C--N 1.363 1.328 0 N-CA-C 104.394 -2.964 . . . . 0.0 104.394 176.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 5.4 t -62.85 148.85 91.12 Favored Pre-proline 0 CA--C 1.545 0.771 0 O-C-N 124.59 1.181 . . . . 0.0 108.39 -178.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -67.43 163.62 33.98 Favored 'Trans proline' 0 N--CA 1.443 -1.465 0 N-CA-C 115.778 1.415 . . . . 0.0 115.778 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -71.62 119.42 6.22 Favored 'Trans proline' 0 C--N 1.364 1.372 0 O-C-N 124.633 1.86 . . . . 0.0 108.589 175.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.353 0.726 0 CA-C-O 123.349 1.547 . . . . 0.0 109.167 178.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.48 ' CB ' ' CD1' ' A' ' 53' ' ' ILE . . . . . . . . 0 CA--C 1.554 1.104 0 CA-C-O 124.645 2.164 . . . . 0.0 109.764 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.4 mm -148.11 123.19 2.25 Favored 'Isoleucine or valine' 0 C--N 1.354 0.793 0 CA-C-N 109.04 -3.709 . . . . 0.0 106.391 -178.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.71 125.87 27.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.919 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -96.55 -22.89 16.8 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 113.119 -1.855 . . . . 0.0 114.215 -179.023 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -142.22 168.87 18.72 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 124.807 1.317 . . . . 0.0 107.75 -179.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -68.0 146.63 53.37 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 118.17 -1.412 . . . . 0.0 107.832 177.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -145.69 128.78 16.59 Favored 'General case' 0 C--N 1.355 0.841 0 C-N-CA 117.385 -1.726 . . . . 0.0 108.967 176.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.21 102.09 9.28 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-N 111.007 -2.815 . . . . 0.0 109.045 -178.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.05 170.02 0.01 OUTLIER 'General case' 0 C--N 1.382 1.996 0 CA-C-O 124.418 2.056 . . . . 0.0 113.28 -179.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.306 44.2 p -123.92 -25.15 4.29 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 109.886 -3.324 . . . . 0.0 111.175 -177.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.05 172.75 16.39 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 117.81 -1.556 . . . . 0.0 112.259 -174.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -59.84 -25.47 65.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 110.99 -2.823 . . . . 0.0 113.931 -177.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -87.32 -7.66 57.55 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 118.952 -1.099 . . . . 0.0 111.082 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -111.24 162.82 14.58 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 114.043 -1.435 . . . . 0.0 107.495 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -138.08 156.84 47.37 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 113.827 -1.533 . . . . 0.0 109.029 178.316 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.1 m -86.59 162.9 17.75 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 123.425 1.583 . . . . 0.0 115.191 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -162.74 167.77 22.51 Favored 'General case' 0 C--N 1.356 0.854 0 CA-C-N 109.307 -3.588 . . . . 0.0 107.871 175.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.52 147.11 52.17 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 111.005 -2.816 . . . . 0.0 104.71 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -43.04 99.49 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.707 0 O-C-N 125.835 1.96 . . . . 0.0 113.089 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.89 -34.41 1.86 Allowed Glycine 0 C--N 1.351 1.389 0 CA-C-N 113.623 -1.626 . . . . 0.0 115.527 177.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -45.85 151.82 0.42 Allowed 'General case' 0 C--N 1.359 1.016 0 N-CA-C 115.687 1.736 . . . . 0.0 115.687 -177.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.9 mt -100.62 121.66 51.67 Favored 'Isoleucine or valine' 0 C--N 1.35 0.622 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 176.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.447 ' CD2' ' CD1' ' A' ' 48' ' ' ILE . 0.0 OUTLIER -106.86 140.96 38.86 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 -179.003 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.02 110.91 23.0 Favored 'General case' 0 C--O 1.209 -1.069 2 CA-C-N 107.181 -4.554 . . . . 0.0 107.622 -179.173 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 3.5 m -88.05 115.58 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 C-N-CA 118.703 -1.199 . . . . 0.0 110.7 -176.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.555 1.158 0 CA-C-N 113.017 -1.901 . . . . 0.0 110.831 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 . . . . . 0 CA--C 1.56 1.354 0 CA-C-O 119.89 -0.1 . . . . 0.0 110.763 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 69.4 m95 -129.65 174.3 9.82 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-O 121.8 0.809 . . . . 0.0 110.25 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -142.83 138.14 30.12 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 126.058 1.743 . . . . 0.0 107.145 174.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.6 tttm -100.2 114.87 28.61 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 175.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -136.08 172.69 12.65 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 118.671 -1.212 . . . . 0.0 111.578 -175.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -112.6 145.46 40.33 Favored 'General case' 0 C--N 1.367 1.355 0 O-C-N 125.481 1.738 . . . . 0.0 110.53 -177.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.295 4.4 mt -159.22 135.6 9.14 Favored 'General case' 0 C--N 1.361 1.104 0 CA-C-N 109.086 -3.688 . . . . 0.0 112.794 178.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.87 28.43 10.43 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 112.431 -2.168 . . . . 0.0 114.971 170.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 72.37 29.14 66.59 Favored Glycine 0 CA--C 1.55 2.244 0 C-N-CA 119.775 -1.202 . . . . 0.0 114.067 -179.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -139.31 157.82 45.23 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 126.782 2.033 . . . . 0.0 107.711 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -139.73 142.28 36.83 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -176.95 173.62 46.44 Favored Glycine 0 CA--C 1.53 1.024 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.874 -179.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -77.18 145.36 37.71 Favored 'General case' 0 CA--C 1.573 1.827 0 CA-C-O 122.834 1.302 . . . . 0.0 111.542 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.447 ' CD1' ' CD2' ' A' ' 25' ' ' LEU . 47.2 pt -143.73 143.89 25.11 Favored Pre-proline 0 C--N 1.355 0.827 0 CA-C-N 113.6 -1.636 . . . . 0.0 107.685 178.025 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -73.06 144.91 38.66 Favored 'Trans proline' 0 C--N 1.346 0.447 0 N-CA-C 114.318 0.853 . . . . 0.0 114.318 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.04 -40.79 71.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 115.071 -2.652 . . . . 0.0 111.985 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -55.43 -19.39 9.15 Favored 'General case' 0 CA--C 1.562 1.411 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 177.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -93.25 -4.39 51.96 Favored 'General case' 0 C--N 1.366 1.309 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.48 ' CD1' ' CB ' ' A' ' 3' ' ' ALA . 0.4 OUTLIER -129.25 176.92 7.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.665 0 CA-C-O 122.991 1.377 . . . . 0.0 111.216 -179.412 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -132.32 138.53 47.83 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 110.807 -2.906 . . . . 0.0 104.942 177.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.35 0.611 0 O-C-N 124.25 0.969 . . . . 0.0 111.691 176.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 N--CA 1.44 -1.645 0 N-CA-C 114.378 0.876 . . . . 0.0 114.378 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -51.79 162.09 1.89 Allowed 'Trans proline' 0 C--N 1.367 1.51 0 C-N-CA 122.602 2.201 . . . . 0.0 115.577 177.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -82.96 109.28 1.69 Allowed 'Trans proline' 0 CA--C 1.539 0.75 0 N-CA-C 105.931 -2.373 . . . . 0.0 105.931 175.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.412 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 2.5 t -49.1 148.05 4.48 Favored Pre-proline 0 CA--C 1.56 1.353 0 CA-C-N 113.563 -1.653 . . . . 0.0 111.802 -177.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' PRO . . . . . 0.412 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 26.8 Cg_exo -67.3 153.98 75.46 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 123.06 2.506 . . . . 0.0 115.689 178.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -65.85 114.35 2.92 Favored 'Trans proline' 0 C--N 1.372 1.794 0 N-CA-C 107.106 -1.921 . . . . 0.0 107.106 175.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.22 -0.482 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.4 ttm . . . . . 0 CA--C 1.539 0.525 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -115.21 153.13 31.42 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 123.317 1.532 . . . . 0.0 107.605 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -137.87 156.04 48.33 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 110.248 -3.16 . . . . 0.0 107.46 -178.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.433 ' H ' HG13 ' A' ' 53' ' ' ILE . 47.4 mm -143.7 116.37 3.03 Favored 'Isoleucine or valine' 0 C--N 1.349 0.574 0 CA-C-N 112.484 -2.143 . . . . 0.0 109.623 -175.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.27 125.89 27.84 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.185 177.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.1 mmmt -97.35 -26.0 15.03 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.002 -0.999 . . . . 0.0 113.055 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -142.08 168.28 20.11 Favored 'General case' 0 C--N 1.351 0.645 0 O-C-N 125.031 1.457 . . . . 0.0 107.847 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -68.98 145.43 53.6 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 113.591 -1.64 . . . . 0.0 109.129 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -146.95 128.92 15.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 116.946 -1.902 . . . . 0.0 111.166 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.2 mmtp -120.49 112.94 19.59 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 112.346 -2.207 . . . . 0.0 108.028 179.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.84 158.88 0.19 Allowed 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 123.408 1.575 . . . . 0.0 113.938 -177.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.1 p -114.28 -22.47 9.91 Favored 'General case' 0 C--N 1.346 0.417 0 CA-C-N 110.719 -2.946 . . . . 0.0 112.258 -177.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -154.03 173.05 16.53 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 113.354 -1.748 . . . . 0.0 111.238 -177.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -54.96 -31.27 60.49 Favored 'General case' 0 CA--C 1.553 1.078 0 CA-C-N 110.278 -3.147 . . . . 0.0 114.478 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 55.0 p-10 -88.88 -2.7 58.72 Favored 'General case' 0 C--N 1.353 0.739 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -178.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -112.94 156.6 22.73 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.011 -1.45 . . . . 0.0 108.552 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.8 pp -135.04 152.38 51.64 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 111.994 -2.366 . . . . 0.0 108.64 177.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . 0.281 57.7 m -82.23 170.88 14.91 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 112.013 -2.358 . . . . 0.0 112.462 -177.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -163.81 -176.58 4.67 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 108.709 -3.86 . . . . 0.0 106.501 172.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.27 144.54 36.51 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.87 102.16 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.247 0 O-C-N 125.068 1.48 . . . . 0.0 112.514 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 136.25 -24.03 3.27 Favored Glycine 0 C--N 1.355 1.635 0 CA-C-N 115.016 -0.993 . . . . 0.0 114.584 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -50.49 142.48 10.55 Favored 'General case' 0 C--N 1.359 1.01 0 CA-C-O 122.8 1.286 . . . . 0.0 114.2 -179.407 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.7 mm -99.0 116.67 42.65 Favored 'Isoleucine or valine' 0 C--N 1.348 0.533 0 N-CA-C 102.156 -3.276 . . . . 0.0 102.156 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.1 mp -107.2 155.04 20.35 Favored 'General case' 0 C--N 1.349 0.545 0 O-C-N 124.606 1.191 . . . . 0.0 111.547 -176.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.63 110.92 23.01 Favored 'General case' 0 C--N 1.355 0.807 0 CA-C-N 111.343 -2.662 . . . . 0.0 108.854 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 58.9 t -87.42 106.96 16.67 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 C-N-CA 116.915 -1.914 . . . . 0.0 110.016 -176.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.7 tp -94.26 -99.16 0.15 Allowed 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 112.148 -2.296 . . . . 0.0 107.516 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -74.97 160.27 30.77 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-O 122.706 1.241 . . . . 0.0 110.265 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -168.93 105.32 0.41 Allowed 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 111.766 -2.47 . . . . 0.0 105.495 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -84.04 29.01 0.57 Allowed 'General case' 0 C--N 1.358 0.967 0 CA-C-N 113.495 -1.684 . . . . 0.0 113.665 -178.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 96.8 m 58.51 23.57 10.92 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 112.622 -2.081 . . . . 0.0 113.339 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.76 147.13 53.02 Favored 'General case' 0 C--N 1.356 0.874 0 N-CA-C 107.151 -1.426 . . . . 0.0 107.151 177.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 28.2 pt20 -108.34 44.9 1.06 Allowed 'General case' 0 C--O 1.223 -0.309 0 CA-C-N 112.596 -2.093 . . . . 0.0 111.37 -177.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 49.5 m-20 -169.41 -18.14 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 111.576 -2.556 . . . . 0.0 113.212 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -140.26 166.41 24.75 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.776 0.798 . . . . 0.0 112.346 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -142.22 146.17 34.89 Favored 'General case' 0 C--N 1.357 0.923 0 CA-C-N 113.228 -1.806 . . . . 0.0 109.648 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.9 tttt -101.54 118.99 38.08 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 175.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.27 172.11 13.13 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 119.101 -1.04 . . . . 0.0 111.841 -177.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -109.77 136.23 49.42 Favored 'General case' 0 C--N 1.36 1.036 0 CA-C-N 114.128 -1.396 . . . . 0.0 111.227 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.283 11.2 mt -160.13 136.02 8.49 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-N 111.755 -2.475 . . . . 0.0 114.611 179.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 57.3 21.49 6.77 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 110.731 -2.94 . . . . 0.0 116.32 170.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 94.74 10.7 57.56 Favored Glycine 0 CA--C 1.538 1.489 0 O-C-N 124.299 0.999 . . . . 0.0 113.557 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -132.01 169.42 16.36 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-O 122.137 0.97 . . . . 0.0 108.939 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -141.51 129.82 22.34 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 112.37 -2.196 . . . . 0.0 107.51 179.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.07 -179.96 43.32 Favored Glycine 0 C--N 1.348 1.244 0 C-N-CA 118.768 -1.682 . . . . 0.0 111.842 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -77.52 146.34 36.42 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 113.121 -1.539 . . . . 0.0 110.825 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 2.6 pt -142.83 144.26 28.86 Favored Pre-proline 0 CA--C 1.542 0.666 0 CA-C-N 111.125 -2.761 . . . . 0.0 106.843 179.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -79.2 145.79 19.45 Favored 'Trans proline' 0 C--N 1.364 1.377 0 N-CA-C 115.417 1.276 . . . . 0.0 115.417 -178.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -67.37 -44.24 79.43 Favored 'General case' 0 C--N 1.358 0.958 0 CA-C-N 113.996 -1.456 . . . . 0.0 111.568 -177.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.292 0.7 OUTLIER -67.36 -10.21 48.88 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 116.794 -1.962 . . . . 0.0 114.255 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -93.62 -10.2 35.44 Favored 'General case' 0 C--N 1.359 1.003 0 CA-C-O 118.417 -0.802 . . . . 0.0 111.474 176.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.516 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -131.07 175.12 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-O 122.93 1.347 . . . . 0.0 110.088 179.864 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.516 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 33.3 tt0 -135.67 133.79 38.52 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 111.931 -2.395 . . . . 0.0 106.666 176.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 5.5 mtm -85.87 158.74 19.86 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-N 114.55 -1.205 . . . . 0.0 109.481 178.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.5 mtpp -152.79 95.06 3.07 Favored Pre-proline 0 CA--C 1.561 1.375 0 CA-C-N 113.332 -1.758 . . . . 0.0 110.157 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo . . . . . 0 C--N 1.371 1.738 0 C-N-CA 122.129 1.886 . . . . 0.0 112.971 177.835 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.291 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 97.5 t -77.75 116.55 59.24 Favored Pre-proline 0 CA--C 1.544 0.722 0 N-CA-C 105.082 -2.192 . . . . 0.0 105.082 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -69.78 159.67 52.55 Favored 'Trans proline' 0 C--N 1.364 1.364 0 N-CA-C 115.069 1.142 . . . . 0.0 115.069 178.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -55.84 159.67 11.31 Favored 'Trans proline' 0 C--N 1.365 1.439 0 C-N-CA 122.453 2.102 . . . . 0.0 116.813 177.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -72.13 127.29 12.61 Favored 'Trans proline' 0 C--N 1.365 1.4 0 N-CA-C 105.822 -2.415 . . . . 0.0 105.822 173.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.43 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 3.0 t -71.33 149.55 94.02 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 118.107 -1.437 . . . . 0.0 109.438 -177.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . 0.43 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 15.7 Cg_exo -71.09 155.25 61.77 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 O-C-N 123.539 1.284 . . . . 0.0 114.797 178.204 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -70.54 123.42 9.83 Favored 'Trans proline' 0 CA--C 1.548 1.186 0 N-CA-C 106.306 -2.228 . . . . 0.0 106.306 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.92 156.65 36.13 Favored 'General case' 0 C--N 1.352 0.705 0 C-N-CA 118.639 -1.224 . . . . 0.0 109.046 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 8.2 mmm-85 72.1 43.34 0.53 Allowed 'General case' 0 CA--C 1.543 0.712 0 CA-C-N 112.841 -1.981 . . . . 0.0 111.954 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.85 107.15 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.339 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.921 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.29 0 CA-C-N 114.435 -1.257 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 ttt . . . . . 0 N--CA 1.443 -0.822 0 CA-C-O 122.32 1.057 . . . . 0.0 108.419 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -115.77 151.6 34.87 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 111.254 -2.703 . . . . 0.0 107.393 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -139.57 156.9 46.61 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 110.781 -2.918 . . . . 0.0 109.392 -178.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.1 mt -147.0 116.17 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.646 0 CA-C-N 111.422 -2.626 . . . . 0.0 109.526 -178.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.27 129.51 40.13 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.747 177.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.0 mmmt -96.46 -23.67 16.47 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 113.797 -1.547 . . . . 0.0 113.291 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -141.92 168.81 18.88 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 125.203 1.564 . . . . 0.0 108.046 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -68.82 146.89 52.48 Favored 'General case' 0 C--N 1.357 0.892 0 CA-C-N 113.283 -1.781 . . . . 0.0 107.429 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -146.87 133.6 20.0 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 117.4 -1.72 . . . . 0.0 108.837 176.152 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm -122.08 112.17 17.91 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 113.88 -1.509 . . . . 0.0 107.056 177.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.9 154.63 0.7 Allowed 'General case' 0 C--N 1.381 1.943 0 CA-C-O 121.942 0.877 . . . . 0.0 112.639 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.9 p -113.26 -17.2 12.38 Favored 'General case' 0 C--N 1.36 1.035 0 CA-C-N 112.372 -2.195 . . . . 0.0 113.964 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.58 163.25 39.47 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 114.226 -1.352 . . . . 0.0 109.041 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -52.12 -30.63 27.19 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 110.709 -2.95 . . . . 0.0 115.008 -177.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 48.1 p-10 -87.97 -1.5 58.03 Favored 'General case' 0 C--N 1.358 0.971 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -177.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -109.1 160.04 16.38 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 113.835 -1.53 . . . . 0.0 108.125 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.13 151.88 51.11 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 179.12 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 25.9 m -83.04 168.27 17.09 Favored 'General case' 0 CA--C 1.56 1.365 0 CA-C-N 112.851 -1.977 . . . . 0.0 113.753 -178.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -164.08 -174.19 3.47 Favored 'General case' 0 C--N 1.354 0.766 0 CA-C-N 112.591 -2.095 . . . . 0.0 107.818 173.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.86 146.22 40.95 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 112.968 -1.924 . . . . 0.0 105.842 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -47.23 102.48 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.254 0 O-C-N 125.575 1.797 . . . . 0.0 111.537 178.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 127.05 -16.38 6.41 Favored Glycine 0 CA--C 1.541 1.678 0 CA-C-N 113.327 -1.76 . . . . 0.0 116.055 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -52.42 147.75 7.72 Favored 'General case' 0 C--N 1.365 1.255 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -177.033 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 88.0 mt -99.14 113.43 34.03 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 175.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.5 mp -107.71 160.05 16.01 Favored 'General case' 0 C--N 1.35 0.627 0 CA-C-O 122.86 1.314 . . . . 0.0 110.664 -178.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.4 ttmt -101.6 112.35 24.89 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 109.911 -3.313 . . . . 0.0 106.747 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 25.0 t -87.8 98.1 7.23 Favored 'Isoleucine or valine' 0 C--N 1.349 0.558 0 C-N-CA 113.058 -3.457 . . . . 0.0 108.494 -177.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.81 93.54 6.74 Favored 'General case' 0 C--N 1.353 0.721 0 CA-C-N 112.587 -2.097 . . . . 0.0 107.185 177.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.8 t30 90.44 137.92 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 113.487 -1.688 . . . . 0.0 108.984 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -155.37 102.88 2.29 Favored 'General case' 0 C--N 1.35 0.626 0 CA-C-N 111.082 -2.781 . . . . 0.0 106.869 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 137.76 121.41 0.0 OUTLIER 'General case' 0 C--N 1.355 0.841 0 C-N-CA 129.176 2.991 . . . . 0.0 107.738 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 p 160.76 -41.86 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 113.03 -1.896 . . . . 0.0 110.933 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -153.06 108.57 3.27 Favored 'General case' 0 C--N 1.349 0.581 0 N-CA-C 105.885 -1.894 . . . . 0.0 105.885 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -72.89 107.66 5.4 Favored 'General case' 0 C--N 1.353 0.751 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 -178.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 141.41 -15.85 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 128.34 2.656 . . . . 0.0 112.573 -178.399 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -137.97 153.94 49.4 Favored 'General case' 0 C--N 1.363 1.155 0 O-C-N 123.638 0.586 . . . . 0.0 109.997 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -130.61 151.54 50.96 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -100.72 122.17 42.91 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 178.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -143.53 168.13 20.59 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 118.736 -1.186 . . . . 0.0 113.61 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -111.59 135.16 52.55 Favored 'General case' 0 C--N 1.368 1.387 0 O-C-N 125.396 1.685 . . . . 0.0 111.13 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.298 12.4 mt -162.97 143.77 9.55 Favored 'General case' 0 C--N 1.345 0.372 0 CA-C-N 110.695 -2.957 . . . . 0.0 113.93 177.773 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.58 29.62 18.71 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 110.479 -3.055 . . . . 0.0 115.501 170.524 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 75.77 18.61 79.57 Favored Glycine 0 CA--C 1.545 1.954 0 CA-C-N 114.434 -1.257 . . . . 0.0 114.088 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -138.93 171.38 14.42 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 124.828 1.251 . . . . 0.0 109.352 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -143.05 139.67 30.62 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 112.145 -2.298 . . . . 0.0 108.252 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -179.24 177.37 48.35 Favored Glycine 0 C--N 1.349 1.264 0 C-N-CA 118.977 -1.582 . . . . 0.0 112.386 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -77.68 145.92 36.34 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-N 113.311 -1.445 . . . . 0.0 110.164 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.6 pt -141.79 144.78 34.1 Favored Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 111.961 -2.381 . . . . 0.0 107.56 179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -76.7 149.58 30.16 Favored 'Trans proline' 0 C--N 1.369 1.629 0 N-CA-C 116.028 1.511 . . . . 0.0 116.028 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.15 -49.26 62.14 Favored 'General case' 0 C--N 1.353 0.732 0 CA-C-N 112.718 -2.037 . . . . 0.0 111.434 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.253 0.7 OUTLIER -65.54 -7.58 15.33 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 117.08 -1.848 . . . . 0.0 115.92 -179.307 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -93.04 -11.1 33.89 Favored 'General case' 0 C--N 1.358 0.97 0 CA-C-O 118.34 -0.838 . . . . 0.0 112.495 177.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.469 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -128.06 170.32 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-O 122.346 1.07 . . . . 0.0 108.82 178.52 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.469 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 17.7 tt0 -128.46 132.96 48.42 Favored 'General case' 0 C--N 1.354 0.775 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -84.91 167.98 15.45 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 112.437 -2.165 . . . . 0.0 111.036 -179.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -152.12 86.72 4.41 Favored Pre-proline 0 CA--C 1.547 0.853 0 CA-C-N 110.521 -3.036 . . . . 0.0 105.49 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo . . . . . 0 C--N 1.377 2.05 0 C-N-CA 123.349 2.7 . . . . 0.0 116.956 -178.942 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.373 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 13.1 p -44.99 122.41 4.82 Favored Pre-proline 0 CA--C 1.544 0.728 0 O-C-N 124.884 1.365 . . . . 0.0 111.406 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -70.97 159.77 51.46 Favored 'Trans proline' 0 CA--C 1.553 1.471 0 N-CA-C 117.245 1.979 . . . . 0.0 117.245 178.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -59.21 160.31 19.68 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 124.341 3.361 . . . . 0.0 117.01 177.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -76.17 118.9 5.12 Favored 'Trans proline' 0 C--N 1.368 1.563 0 N-CA-C 106.314 -2.226 . . . . 0.0 106.314 174.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.433 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 3.1 t -62.73 147.35 93.37 Favored Pre-proline 0 CA--C 1.538 0.515 0 CA-C-N 113.001 -1.909 . . . . 0.0 109.739 -178.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . 0.433 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 18.1 Cg_exo -66.66 157.41 61.06 Favored 'Trans proline' 0 C--N 1.359 1.097 0 O-C-N 123.137 1.072 . . . . 0.0 114.468 178.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -67.69 120.88 7.9 Favored 'Trans proline' 0 C--N 1.365 1.411 0 N-CA-C 105.904 -2.383 . . . . 0.0 105.904 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.27 79.56 8.5 Favored 'General case' 0 C--N 1.357 0.928 0 O-C-N 124.492 1.12 . . . . 0.0 110.778 -178.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 14.4 ptt180 164.36 56.99 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 110.71 -2.95 . . . . 0.0 111.236 178.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 61.35 92.38 0.05 Allowed 'General case' 0 CA--C 1.552 1.035 0 CA-C-O 122.84 1.305 . . . . 0.0 112.414 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.157 0 CA-C-N 112.856 -1.975 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.7 ttp . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -109.5 149.26 29.87 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 112.622 -2.081 . . . . 0.0 105.651 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -139.31 153.38 47.73 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 111.761 -2.472 . . . . 0.0 109.362 -177.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.421 ' H ' HG13 ' A' ' 53' ' ' ILE . 15.1 mt -149.03 120.03 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.635 0 CA-C-N 112.297 -2.229 . . . . 0.0 108.745 -177.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 128.38 36.35 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.602 -1.635 . . . . 0.0 111.883 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.45 -24.77 15.95 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 114.42 -1.263 . . . . 0.0 113.315 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -139.89 167.61 21.72 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 118.946 -1.102 . . . . 0.0 108.781 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -67.61 145.98 54.31 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 113.725 -1.579 . . . . 0.0 108.135 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -146.66 136.5 23.27 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 122.6 1.191 . . . . 0.0 109.591 176.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.13 106.57 9.66 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 112.776 -2.011 . . . . 0.0 108.003 178.08 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.11 157.97 0.16 Allowed 'General case' 0 C--N 1.36 1.023 0 CA-C-O 122.631 1.205 . . . . 0.0 113.753 -178.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.9 p -112.84 -17.96 12.39 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 110.942 -2.845 . . . . 0.0 112.054 -177.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.71 169.02 24.34 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 123.071 1.415 . . . . 0.0 111.812 -176.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -50.53 -36.36 33.89 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 110.59 -3.004 . . . . 0.0 112.913 -179.011 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 39.3 p30 -87.38 -1.4 57.9 Favored 'General case' 0 C--N 1.356 0.851 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -107.69 157.75 17.84 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 124.368 1.042 . . . . 0.0 108.419 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -132.74 155.12 49.45 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 114.047 -1.433 . . . . 0.0 107.187 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.8 m -84.3 171.5 12.65 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 123.661 1.696 . . . . 0.0 114.055 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -167.43 163.62 14.98 Favored 'General case' 0 C--N 1.347 0.465 0 CA-C-N 111.364 -2.653 . . . . 0.0 107.976 174.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -127.39 141.06 51.79 Favored 'General case' 0 C--O 1.223 -0.316 0 N-CA-C 105.45 -2.055 . . . . 0.0 105.45 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -40.81 99.63 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.061 0 O-C-N 125.986 2.054 . . . . 0.0 113.843 -176.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 129.55 -7.75 6.21 Favored Glycine 0 C--N 1.36 1.884 0 CA-C-N 113.562 -1.654 . . . . 0.0 116.115 178.312 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -61.61 146.76 47.92 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 117.334 -1.746 . . . . 0.0 112.783 -179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 26.6 mm -99.08 112.85 32.3 Favored 'Isoleucine or valine' 0 C--N 1.347 0.474 0 N-CA-C 104.516 -2.401 . . . . 0.0 104.516 177.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.1 mp -107.16 160.92 15.21 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 118.301 -1.36 . . . . 0.0 111.693 -175.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.08 113.97 27.89 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 110.403 -3.089 . . . . 0.0 107.737 177.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 57.5 t -85.86 121.29 37.13 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 C-N-CA 116.486 -2.086 . . . . 0.0 106.885 -177.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 27.2 tp -142.29 84.74 1.88 Allowed 'General case' 0 C--N 1.345 0.39 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.581 -175.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.522 HD21 ' HZ3' ' A' ' 38' ' ' LYS . 85.8 m-20 106.89 148.46 0.01 OUTLIER 'General case' 0 C--N 1.35 0.604 0 CA-C-N 110.783 -2.917 . . . . 0.0 108.297 179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -175.93 74.71 0.02 OUTLIER 'General case' 0 C--N 1.348 0.529 0 CA-C-N 112.547 -2.115 . . . . 0.0 106.975 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -166.96 72.59 0.13 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 111.572 -2.558 . . . . 0.0 108.471 -177.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.3 t -158.39 -43.61 0.06 Allowed 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 111.207 -2.724 . . . . 0.0 110.747 178.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -162.3 120.83 2.22 Favored 'General case' 0 C--N 1.36 1.03 0 O-C-N 124.096 0.873 . . . . 0.0 109.702 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -69.82 110.29 4.89 Favored 'General case' 0 C--N 1.351 0.653 0 N-CA-C 105.232 -2.136 . . . . 0.0 105.232 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.6 m120 143.77 -14.43 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 O-C-N 126.225 2.203 . . . . 0.0 111.554 -179.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.8 m95 -136.91 153.28 50.78 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -178.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -127.02 147.97 50.13 Favored 'General case' 0 C--N 1.355 0.846 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 178.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.522 ' HZ3' HD21 ' A' ' 29' ' ' ASN . 11.8 ttmt -102.03 116.28 32.35 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 104.133 -2.544 . . . . 0.0 104.133 176.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.38 173.74 11.29 Favored 'General case' 0 C--N 1.349 0.574 0 C-N-CA 119.086 -1.046 . . . . 0.0 111.154 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -109.26 141.83 41.0 Favored 'General case' 0 C--N 1.359 1.003 0 O-C-N 125.64 1.837 . . . . 0.0 110.675 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 mt -158.66 119.47 3.33 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 110.575 -3.011 . . . . 0.0 115.76 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.367 0.0 OUTLIER 61.87 33.17 17.74 Favored 'General case' 0 C--N 1.384 2.092 1 C-N-CA 110.051 -4.66 . . . . 0.0 118.564 173.671 . . . . . . . . 4 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.62 22.39 59.28 Favored Glycine 0 CA--C 1.546 2.022 0 C-N-CA 116.227 -2.892 . . . . 0.0 112.384 -178.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.45 137.22 47.18 Favored 'General case' 0 C--N 1.353 0.72 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 179.424 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 18.4 p-10 -130.17 145.77 51.75 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 -178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 176.19 178.79 46.25 Favored Glycine 0 C--N 1.34 0.769 0 C-N-CA 116.313 -2.851 . . . . 0.0 112.388 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -76.93 143.03 39.82 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-O 123.414 1.578 . . . . 0.0 109.331 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.2 pt -143.37 144.19 27.12 Favored Pre-proline 0 C--O 1.218 -0.556 0 CA-C-N 111.412 -2.631 . . . . 0.0 106.195 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -77.09 147.53 26.58 Favored 'Trans proline' 0 C--N 1.356 0.968 0 N-CA-C 116.237 1.591 . . . . 0.0 116.237 -177.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.14 -45.76 66.14 Favored 'General case' 0 C--N 1.358 0.938 0 C-N-CA 116.922 -1.911 . . . . 0.0 110.843 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.313 0.5 OUTLIER -62.6 -7.38 4.64 Favored 'General case' 0 CA--C 1.557 1.235 0 C-N-CA 115.137 -2.625 . . . . 0.0 115.617 -177.838 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -93.42 -10.52 34.86 Favored 'General case' 0 CA--C 1.559 1.302 0 CA-C-O 118.738 -0.648 . . . . 0.0 111.611 176.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.433 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -127.3 168.85 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-O 122.314 1.054 . . . . 0.0 108.707 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.433 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 3.5 tt0 -120.94 136.66 54.91 Favored 'General case' 0 C--N 1.352 0.694 0 N-CA-C 103.11 -2.922 . . . . 0.0 103.11 176.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.89 168.7 14.8 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 113.233 -1.803 . . . . 0.0 110.212 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -151.12 79.27 6.93 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-N 112.009 -2.359 . . . . 0.0 106.348 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo . . . . . 0 C--N 1.368 1.554 0 O-C-N 124.218 1.641 . . . . 0.0 111.723 179.742 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.258 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 69.1 t -52.28 110.13 1.76 Allowed Pre-proline 0 C--N 1.349 0.585 0 O-C-N 125.508 1.755 . . . . 0.0 111.838 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -76.63 158.72 35.74 Favored 'Trans proline' 0 N--CA 1.436 -1.91 0 N-CA-C 115.563 1.332 . . . . 0.0 115.563 176.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -58.95 158.41 25.17 Favored 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 122.36 2.04 . . . . 0.0 115.89 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -70.14 119.57 6.47 Favored 'Trans proline' 0 C--N 1.362 1.271 0 N-CA-C 106.07 -2.319 . . . . 0.0 106.07 175.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 16.6 t -64.63 149.34 95.76 Favored Pre-proline 0 CA--C 1.543 0.7 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.995 -177.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.05 158.66 53.22 Favored 'Trans proline' 0 C--N 1.362 1.256 0 O-C-N 123.052 1.027 . . . . 0.0 114.361 178.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -78.89 118.52 4.12 Favored 'Trans proline' 0 C--N 1.358 1.027 0 N-CA-C 106.549 -2.135 . . . . 0.0 106.549 176.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.17 156.6 28.14 Favored 'General case' 0 C--N 1.352 0.694 0 C-N-CA 117.287 -1.765 . . . . 0.0 109.2 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.5 mtm105 60.14 42.82 14.94 Favored 'General case' 0 C--N 1.35 0.587 0 CA-C-N 112.401 -2.181 . . . . 0.0 112.93 178.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 30.96 79.56 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 O-C-N 125.982 2.051 . . . . 0.0 112.663 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 110.865 -2.88 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 ttp . . . . . 0 N--CA 1.448 -0.572 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -112.39 149.66 32.21 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 112.963 -1.926 . . . . 0.0 106.748 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -137.41 161.7 35.62 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 111.572 -2.558 . . . . 0.0 108.68 -178.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.275 16.4 mm -145.47 118.39 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-N 110.587 -3.006 . . . . 0.0 108.888 -176.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.45 125.54 26.81 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 117.054 -1.858 . . . . 0.0 107.83 176.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.8 mtmt -95.2 -24.89 16.61 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.467 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 52.2 m-85 -141.46 167.41 22.23 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -67.93 147.0 53.07 Favored 'General case' 0 C--N 1.352 0.698 0 CA-C-N 114.049 -1.432 . . . . 0.0 107.494 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -147.37 129.64 15.66 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 116.819 -1.952 . . . . 0.0 110.214 176.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.5 116.42 24.66 Favored 'General case' 0 CA--C 1.569 1.687 0 CA-C-N 113.699 -1.591 . . . . 0.0 107.407 177.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.58 159.87 0.09 Allowed 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 123.537 1.637 . . . . 0.0 115.185 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 28.4 p -119.14 -15.64 9.19 Favored 'General case' 0 C--N 1.353 0.751 0 CA-C-N 110.162 -3.199 . . . . 0.0 114.057 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.09 160.45 43.43 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 123.052 1.406 . . . . 0.0 111.443 -178.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -49.28 -32.2 10.42 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-N 111.066 -2.788 . . . . 0.0 113.462 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -89.32 -2.16 58.34 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.988 1.847 . . . . 0.0 115.988 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -106.89 162.82 13.48 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 114.051 -1.432 . . . . 0.0 107.761 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -134.58 152.4 51.75 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.058 -1.428 . . . . 0.0 107.824 179.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 4.2 m -85.0 164.76 18.07 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 124.31 2.005 . . . . 0.0 113.048 -178.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -162.16 178.59 8.63 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 111.431 -2.622 . . . . 0.0 108.168 173.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.19 145.98 44.35 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 111.853 -2.431 . . . . 0.0 104.723 -178.28 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -47.48 100.43 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 O-C-N 125.69 1.869 . . . . 0.0 112.191 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.59 -14.7 5.54 Favored Glycine 0 C--N 1.353 1.482 0 CA-C-O 118.634 -1.092 . . . . 0.0 115.548 179.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 37.5 m-20 -53.71 146.09 14.19 Favored 'General case' 0 C--N 1.365 1.269 0 C-N-CA 118.746 -1.182 . . . . 0.0 112.289 -179.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.3 mm -95.6 116.45 37.28 Favored 'Isoleucine or valine' 0 C--N 1.352 0.688 0 N-CA-C 100.876 -3.75 . . . . 0.0 100.876 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -106.61 153.19 22.72 Favored 'General case' 0 C--N 1.348 0.52 0 CA-C-N 113.174 -1.83 . . . . 0.0 111.363 -175.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -104.58 109.06 20.81 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 109.798 -3.364 . . . . 0.0 109.288 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 55.8 t -86.92 110.31 20.18 Favored 'Isoleucine or valine' 0 C--N 1.344 0.356 0 C-N-CA 116.687 -2.005 . . . . 0.0 110.065 -176.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.2 tp -93.62 -108.31 0.12 Allowed 'General case' 0 CA--C 1.551 0.984 0 CA-C-N 112.792 -2.003 . . . . 0.0 109.325 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -74.32 -179.69 4.07 Favored 'General case' 0 C--N 1.359 1.006 0 CA-C-O 121.702 0.763 . . . . 0.0 111.185 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 172.36 60.11 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 112.559 -2.109 . . . . 0.0 109.931 179.07 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . 0.259 18.0 pt-20 -75.1 -133.27 0.01 OUTLIER 'General case' 0 C--N 1.353 0.749 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.404 178.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 39.2 t -34.56 -47.55 0.33 Allowed 'General case' 0 CA--C 1.551 0.993 0 CA-C-N 112.841 -1.981 . . . . 0.0 113.817 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.4 p30 -51.28 105.93 0.12 Allowed 'General case' 0 C--N 1.357 0.924 0 CA-C-O 123.14 1.447 . . . . 0.0 112.855 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.15 -37.43 17.35 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 112.429 -2.169 . . . . 0.0 112.865 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -92.1 -14.94 28.44 Favored 'General case' 0 N--CA 1.436 -1.135 1 C-N-CA 134.36 5.064 . . . . 0.0 113.519 -176.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -135.21 159.27 42.07 Favored 'General case' 0 CA--C 1.553 1.069 0 O-C-N 124.82 1.325 . . . . 0.0 109.218 -179.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -134.96 148.23 49.96 Favored 'General case' 0 C--N 1.354 0.78 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.5 ttpp -99.89 117.92 35.22 Favored 'General case' 0 C--N 1.354 0.799 0 N-CA-C 104.442 -2.429 . . . . 0.0 104.442 177.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.48 176.84 8.38 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 113.815 -1.539 . . . . 0.0 111.061 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -126.61 143.79 51.11 Favored 'General case' 0 C--N 1.356 0.871 0 O-C-N 125.33 1.644 . . . . 0.0 110.856 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.289 10.8 mt -161.9 142.62 10.61 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 109.766 -3.379 . . . . 0.0 113.084 178.982 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.94 30.3 18.93 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 111.544 -2.571 . . . . 0.0 116.352 170.304 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.95 11.61 85.23 Favored Glycine 0 CA--C 1.545 1.95 0 C-N-CA 119.305 -1.426 . . . . 0.0 114.975 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -136.08 165.24 26.16 Favored 'General case' 0 C--N 1.352 0.689 0 C-N-CA 124.448 1.099 . . . . 0.0 108.055 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -139.44 139.06 36.96 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 112.84 -1.982 . . . . 0.0 108.011 -179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.48 178.26 44.67 Favored Glycine 0 C--N 1.344 0.988 0 C-N-CA 118.105 -1.998 . . . . 0.0 111.707 -179.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -77.78 146.0 36.09 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 112.628 -1.786 . . . . 0.0 110.369 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 35.0 pt -141.88 143.27 27.95 Favored Pre-proline 0 C--N 1.349 0.551 0 CA-C-N 112.128 -2.306 . . . . 0.0 106.023 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -75.1 139.42 24.0 Favored 'Trans proline' 0 C--N 1.362 1.273 0 CA-C-N 118.972 0.669 . . . . 0.0 112.664 -178.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.7 pttp -70.05 -21.13 63.2 Favored 'General case' 0 C--N 1.358 0.974 0 C-N-CA 114.761 -2.776 . . . . 0.0 112.978 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.62 -18.9 61.55 Favored 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 113.544 -3.262 . . . . 0.0 111.329 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -87.54 -6.87 58.15 Favored 'General case' 0 C--N 1.367 1.358 0 O-C-N 123.851 0.719 . . . . 0.0 112.528 -175.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.459 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -129.76 172.28 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 CA-C-O 121.893 0.854 . . . . 0.0 108.827 177.75 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.459 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 2.4 tt0 -132.87 136.22 46.08 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 112.848 -1.978 . . . . 0.0 105.938 177.457 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 55.2 mtm -84.39 162.85 19.84 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 112.721 -2.036 . . . . 0.0 110.736 -179.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.2 mmtm -151.37 87.66 4.5 Favored Pre-proline 0 CA--C 1.551 0.983 0 CA-C-N 112.333 -2.212 . . . . 0.0 109.801 -178.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 C--N 1.367 1.552 0 C-N-CA 122.086 1.857 . . . . 0.0 111.473 177.817 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.272 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 39.1 t -78.03 107.45 5.53 Favored Pre-proline 0 CA--C 1.546 0.789 0 O-C-N 125.193 1.558 . . . . 0.0 107.107 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . 0.467 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 1.9 Cg_endo -66.29 158.5 54.67 Favored 'Trans proline' 0 CA--C 1.564 2.013 0 O-C-N 123.375 1.198 . . . . 0.0 115.007 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -57.69 158.12 21.16 Favored 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 124.056 3.17 . . . . 0.0 117.627 179.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -71.61 114.05 3.83 Favored 'Trans proline' 0 C--N 1.357 0.989 0 N-CA-C 106.885 -2.006 . . . . 0.0 106.885 175.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.43 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.1 t -54.58 148.27 26.25 Favored Pre-proline 0 C--N 1.354 0.782 0 CA-C-N 113.473 -1.694 . . . . 0.0 109.864 -178.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . 0.43 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 21.0 Cg_exo -64.38 153.83 74.7 Favored 'Trans proline' 0 C--N 1.359 1.129 0 N-CA-C 114.977 1.107 . . . . 0.0 114.977 178.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -76.63 111.05 3.17 Favored 'Trans proline' 0 C--N 1.362 1.242 0 N-CA-C 107.462 -1.784 . . . . 0.0 107.462 176.328 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -90.52 138.72 31.33 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.395 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 ptt85 177.52 65.33 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 112.284 -2.235 . . . . 0.0 109.634 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.11 -80.26 0.06 Allowed 'General case' 0 C--N 1.347 0.492 0 CA-C-N 113.773 -1.558 . . . . 0.0 108.856 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.487 0 CA-C-N 111.044 -2.798 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ttm . . . . . 0 CA--C 1.537 0.48 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -92.54 152.92 19.37 Favored 'General case' 0 C--N 1.362 1.123 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 179.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -141.58 154.62 45.54 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 110.304 -3.134 . . . . 0.0 105.287 -177.015 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 mt -154.43 134.35 3.97 Favored 'Isoleucine or valine' 0 C--N 1.348 0.508 0 C-N-CA 117.553 -1.659 . . . . 0.0 109.59 -175.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -66.92 129.45 39.94 Favored 'General case' 0 CA--C 1.557 1.214 0 CA-C-N 112.504 -2.135 . . . . 0.0 109.596 177.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -97.44 -27.19 14.56 Favored 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 113.839 -1.528 . . . . 0.0 111.954 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 65.0 m-85 -142.44 170.46 15.66 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 113.32 -1.763 . . . . 0.0 106.956 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.32 142.87 47.1 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 118.807 -1.157 . . . . 0.0 108.413 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -147.18 127.17 13.63 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 117.418 -1.713 . . . . 0.0 111.225 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.94 118.78 33.9 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 112.763 -2.017 . . . . 0.0 108.142 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.85 151.53 1.2 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 122.181 0.991 . . . . 0.0 112.216 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.79 -11.0 9.06 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-N 112.06 -2.336 . . . . 0.0 112.126 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.43 164.99 37.21 Favored 'General case' 0 C--N 1.356 0.885 0 CA-C-O 123.847 1.784 . . . . 0.0 110.338 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -47.77 -34.67 8.81 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 108.842 -3.799 . . . . 0.0 114.697 -178.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -93.87 0.68 56.31 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 26.7 mp0 -112.97 154.55 26.27 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.399 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.9 pp -134.54 154.92 51.22 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 112.807 -1.997 . . . . 0.0 109.854 177.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . 0.255 58.5 m -82.1 166.7 19.48 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 111.213 -2.721 . . . . 0.0 113.143 -177.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.9 p90 -163.9 -175.95 4.32 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 110.248 -3.16 . . . . 0.0 107.419 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.8 143.82 37.05 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 111.918 -2.401 . . . . 0.0 105.509 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -46.67 98.57 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.441 0 O-C-N 125.168 1.543 . . . . 0.0 112.866 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 131.11 -13.28 5.5 Favored Glycine 0 C--N 1.356 1.66 0 O-C-N 124.525 1.14 . . . . 0.0 115.535 179.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -54.52 145.77 17.8 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 119.109 -1.037 . . . . 0.0 112.684 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.8 mm -97.0 117.0 40.74 Favored 'Isoleucine or valine' 0 C--N 1.352 0.686 0 N-CA-C 103.09 -2.93 . . . . 0.0 103.09 177.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -111.04 148.48 32.52 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 112.173 -2.285 . . . . 0.0 112.542 -175.714 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.14 107.54 18.56 Favored 'General case' 0 C--O 1.213 -0.832 0 CA-C-N 110.705 -2.952 . . . . 0.0 108.475 178.153 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -86.34 99.0 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 C-N-CA 115.133 -2.627 . . . . 0.0 109.778 -176.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.1 tp -94.61 102.86 14.79 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 110.509 -3.041 . . . . 0.0 107.292 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 80.71 130.84 0.05 Allowed 'General case' 0 CA--C 1.551 0.997 0 O-C-N 125.265 1.603 . . . . 0.0 109.405 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -165.05 -175.4 3.68 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 111.576 -2.556 . . . . 0.0 106.813 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 75.25 68.08 0.08 Allowed 'General case' 0 C--N 1.354 0.801 0 CA-C-O 122.864 1.316 . . . . 0.0 109.956 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.7 m -166.86 -74.75 0.03 OUTLIER 'General case' 0 C--N 1.347 0.492 0 CA-C-N 111.284 -2.689 . . . . 0.0 106.748 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.7 139.52 36.1 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 113.541 -1.663 . . . . 0.0 107.129 -179.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -84.77 -23.28 29.28 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 116.191 1.922 . . . . 0.0 116.191 -175.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.508 ' HB2' HH21 ' B' ' 10' ' ' ARG . 19.9 m120 -117.29 -11.33 10.63 Favored 'General case' 0 N--CA 1.436 -1.125 0 C-N-CA 131.082 3.753 . . . . 0.0 115.288 -174.335 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.422 ' CE2' ' HB3' ' B' ' 8' ' ' ARG . 70.5 m95 -132.55 153.98 50.44 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 119.053 0.842 . . . . 0.0 110.929 -178.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.408 ' O ' ' HA ' ' A' ' 47' ' ' PHE 0.261 21.4 m-85 -133.46 148.51 51.74 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 114.595 -1.184 . . . . 0.0 108.514 177.634 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -99.19 119.35 37.72 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 179.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.04 172.54 12.54 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 119.181 -1.008 . . . . 0.0 112.162 -176.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -113.7 134.39 54.78 Favored 'General case' 0 C--N 1.362 1.139 0 O-C-N 125.15 1.531 . . . . 0.0 111.915 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.342 9.4 mt -161.2 137.55 8.35 Favored 'General case' 0 C--N 1.355 0.813 0 CA-C-N 111.662 -2.517 . . . . 0.0 114.565 178.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.9 21.14 5.85 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 110.218 -3.174 . . . . 0.0 116.661 170.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 91.96 15.22 54.87 Favored Glycine 0 C--N 1.353 1.486 0 CA-C-N 114.359 -1.292 . . . . 0.0 113.287 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -134.3 166.74 22.11 Favored 'General case' 0 C--N 1.354 0.773 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -141.96 129.64 21.56 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 112.773 -2.012 . . . . 0.0 107.546 179.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.49 178.56 44.53 Favored Glycine 0 C--N 1.353 1.493 0 C-N-CA 119.318 -1.42 . . . . 0.0 111.995 -177.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . 0.408 ' HA ' ' O ' ' A' ' 37' ' ' TYR . 69.3 m-85 -77.86 146.28 35.77 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 123.062 1.411 . . . . 0.0 113.481 -178.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.2 pt -141.18 144.15 33.54 Favored Pre-proline 0 C--N 1.354 0.788 0 CA-C-N 111.21 -2.723 . . . . 0.0 107.104 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.13 150.49 37.7 Favored 'Trans proline' 0 C--N 1.364 1.383 0 N-CA-C 116.327 1.626 . . . . 0.0 116.327 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . 0.342 0.1 OUTLIER -65.97 -45.39 81.87 Favored 'General case' 0 C--N 1.364 1.227 0 CA-C-N 114.043 -1.435 . . . . 0.0 111.446 179.622 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.319 0.7 OUTLIER -68.66 -11.89 60.7 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 116.116 -2.234 . . . . 0.0 114.306 -178.534 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -92.44 -12.56 31.79 Favored 'General case' 0 C--N 1.357 0.924 0 CA-C-O 117.754 -1.117 . . . . 0.0 112.374 177.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.446 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -133.14 168.67 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-O 122.303 1.049 . . . . 0.0 109.2 178.925 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.446 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 2.0 tt0 -136.92 137.63 39.78 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 113.185 -1.825 . . . . 0.0 107.823 176.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.2 mtm -84.38 168.56 15.46 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 113.707 -1.588 . . . . 0.0 109.072 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -151.01 86.33 4.9 Favored Pre-proline 0 CA--C 1.551 0.996 0 CA-C-N 112.343 -2.208 . . . . 0.0 108.387 -178.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo . . . . . 0 C--N 1.374 1.877 0 C-N-CA 122.6 2.2 . . . . 0.0 110.37 178.441 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.282 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 18.9 t -129.09 89.09 49.46 Favored Pre-proline 0 C--N 1.348 0.541 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -60.31 161.12 20.94 Favored 'Trans proline' 0 C--N 1.365 1.404 0 O-C-N 123.193 1.101 . . . . 0.0 114.337 178.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -51.83 160.19 3.08 Favored 'Trans proline' 0 C--N 1.364 1.379 0 C-N-CA 122.652 2.235 . . . . 0.0 116.999 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -72.97 126.73 11.5 Favored 'Trans proline' 0 C--N 1.367 1.525 0 N-CA-C 105.762 -2.438 . . . . 0.0 105.762 175.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.411 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 10.7 t -70.74 146.71 93.8 Favored Pre-proline 0 CA--C 1.54 0.584 0 C-N-CA 117.688 -1.605 . . . . 0.0 108.92 -177.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . 0.411 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 12.5 Cg_exo -67.9 160.08 50.02 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 O-C-N 123.358 1.188 . . . . 0.0 114.806 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -78.57 116.54 3.83 Favored 'Trans proline' 0 CA--C 1.551 1.329 0 N-CA-C 108.405 -1.421 . . . . 0.0 108.405 176.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.422 ' HB3' ' CE2' ' A' ' 36' ' ' TRP . 0.0 OUTLIER -97.4 104.34 16.35 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 114.304 -1.316 . . . . 0.0 108.865 179.607 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -150.16 50.07 0.9 Allowed 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 112.961 -1.927 . . . . 0.0 110.245 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . 0.508 HH21 ' HB2' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -178.29 155.06 0.88 Allowed 'General case' 0 C--N 1.358 0.964 0 CA-C-N 113.693 -1.594 . . . . 0.0 110.844 178.327 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.196 0 CA-C-N 113.802 -1.544 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.161 0 N-CA-C 106.382 -1.71 . . . . 0.0 106.382 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -110.82 147.54 34.3 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 104.598 -2.371 . . . . 0.0 104.598 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -139.91 153.31 46.93 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 111.324 -2.671 . . . . 0.0 107.271 -177.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.1 mt -148.98 120.93 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 111.381 -2.645 . . . . 0.0 108.23 -176.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.96 134.08 49.05 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 113.325 -1.761 . . . . 0.0 108.401 176.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt -94.22 -22.3 18.5 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 124.415 1.086 . . . . 0.0 112.563 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.419 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 88.0 m-85 -142.33 170.29 15.98 Favored 'General case' 0 C--N 1.35 0.611 0 CA-C-N 113.935 -1.484 . . . . 0.0 108.394 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -72.51 149.29 44.24 Favored 'General case' 0 C--O 1.214 -0.8 0 CA-C-N 113.348 -1.751 . . . . 0.0 108.017 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -145.95 134.61 22.23 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 117.693 -1.603 . . . . 0.0 109.409 176.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -122.37 101.25 7.39 Favored 'General case' 0 CA--C 1.561 1.373 0 CA-C-N 111.694 -2.503 . . . . 0.0 109.773 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.55 152.69 0.89 Allowed 'General case' 0 C--N 1.362 1.131 0 CA-C-O 122.123 0.963 . . . . 0.0 113.028 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.1 p -118.84 -11.81 9.7 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-N 111.848 -2.433 . . . . 0.0 113.156 -177.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.22 163.58 38.53 Favored 'General case' 0 C--N 1.355 0.809 0 CA-C-O 123.323 1.535 . . . . 0.0 110.201 -178.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -49.08 -31.35 7.75 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 110.332 -3.122 . . . . 0.0 115.343 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 57.4 p30 -90.74 -4.13 56.93 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -109.77 158.09 18.48 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 113.693 -1.594 . . . . 0.0 107.791 -179.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -133.41 152.22 51.89 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 111.624 -2.535 . . . . 0.0 108.134 178.441 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 13.3 m -82.94 166.09 19.16 Favored 'General case' 0 C--N 1.354 0.765 0 CA-C-N 112.516 -2.129 . . . . 0.0 112.65 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -163.7 -175.21 4.02 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 111.145 -2.752 . . . . 0.0 107.646 172.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -139.37 147.31 41.33 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.93 100.72 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.031 0 O-C-N 125.269 1.605 . . . . 0.0 112.651 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 129.7 -19.01 5.34 Favored Glycine 0 C--N 1.353 1.476 0 CA-C-O 117.94 -1.478 . . . . 0.0 115.415 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 76.8 m-20 -47.73 149.93 1.15 Allowed 'General case' 0 C--N 1.366 1.325 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -177.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mm -97.14 112.65 29.63 Favored 'Isoleucine or valine' 0 C--N 1.35 0.59 0 N-CA-C 103.54 -2.763 . . . . 0.0 103.54 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.1 mp -108.79 146.47 33.55 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-N 114.083 -1.417 . . . . 0.0 111.992 -175.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.34 112.49 25.4 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-N 111.877 -2.419 . . . . 0.0 107.546 179.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 12.0 t -87.87 99.58 8.98 Favored 'Isoleucine or valine' 0 C--N 1.352 0.679 0 C-N-CA 114.015 -3.074 . . . . 0.0 110.954 -175.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -94.03 93.28 7.76 Favored 'General case' 0 C--N 1.358 0.938 0 CA-C-N 112.976 -1.92 . . . . 0.0 106.009 177.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 80.93 139.39 0.07 Allowed 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 113.154 -1.839 . . . . 0.0 109.073 -178.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -158.53 54.26 0.43 Allowed 'General case' 0 C--N 1.352 0.698 0 CA-C-N 112.545 -2.116 . . . . 0.0 111.386 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . 0.253 0.0 OUTLIER -133.2 -44.06 0.85 Allowed 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.766 1.765 . . . . 0.0 115.766 -178.948 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 25.9 p -75.7 33.99 0.12 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 109.771 -3.377 . . . . 0.0 114.922 -177.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 178.89 126.75 0.06 Allowed 'General case' 0 CA--C 1.557 1.216 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 178.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -84.98 -27.11 26.7 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 -176.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 43.4 m-20 -113.32 -14.18 12.83 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 130.265 3.426 . . . . 0.0 113.884 -176.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -134.03 155.82 49.32 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -136.17 153.61 51.21 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 114.05 -1.432 . . . . 0.0 108.514 177.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.9 ttmt -100.69 123.45 44.91 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 106.525 -1.658 . . . . 0.0 106.525 177.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -142.05 173.44 11.52 Favored 'General case' 0 C--N 1.352 0.677 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.683 -178.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 50.8 tt0 -120.92 136.66 54.9 Favored 'General case' 0 C--N 1.367 1.339 0 O-C-N 124.939 1.399 . . . . 0.0 111.062 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.264 12.3 mt -160.34 142.38 12.82 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 110.222 -3.172 . . . . 0.0 113.655 178.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.03 24.66 9.81 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 109.08 -3.691 . . . . 0.0 115.62 171.297 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.03 14.49 66.89 Favored Glycine 0 C--N 1.357 1.726 0 CA-C-N 114.64 -1.163 . . . . 0.0 113.867 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -134.35 168.13 19.47 Favored 'General case' 0 C--N 1.35 0.605 0 C-N-CA 125.013 1.325 . . . . 0.0 108.662 -179.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -139.49 141.51 37.35 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 112.401 -2.181 . . . . 0.0 107.74 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -177.91 177.95 48.42 Favored Glycine 0 C--N 1.348 1.227 0 C-N-CA 118.268 -1.92 . . . . 0.0 112.755 -178.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -77.94 143.35 37.73 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 112.759 -1.72 . . . . 0.0 111.302 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.5 pt -141.89 143.39 28.4 Favored Pre-proline 0 C--N 1.351 0.662 0 CA-C-N 111.597 -2.547 . . . . 0.0 106.611 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -78.45 151.29 25.75 Favored 'Trans proline' 0 C--N 1.364 1.352 0 N-CA-C 116.775 1.798 . . . . 0.0 116.775 -177.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -44.12 81.93 Favored 'General case' 0 C--N 1.365 1.275 0 C-N-CA 118.159 -1.416 . . . . 0.0 112.002 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.323 0.7 OUTLIER -66.2 -10.77 44.89 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 116.263 -2.175 . . . . 0.0 115.839 -178.787 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 -93.96 -10.55 33.33 Favored 'General case' 0 C--N 1.357 0.923 0 CA-C-O 117.356 -1.307 . . . . 0.0 110.911 177.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.5 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -129.95 169.75 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 CA-C-O 123.071 1.415 . . . . 0.0 109.778 179.211 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.5 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 28.2 tt0 -135.35 133.51 38.84 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 111.179 -2.737 . . . . 0.0 106.198 177.029 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 38.0 mtp -84.99 160.87 19.96 Favored 'General case' 0 C--N 1.353 0.748 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.824 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -151.8 90.48 3.9 Favored Pre-proline 0 CA--C 1.554 1.102 0 CA-C-N 113.653 -1.612 . . . . 0.0 110.662 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo . . . . . 0 C--N 1.367 1.506 0 C-N-CA 122.793 2.329 . . . . 0.0 111.231 177.017 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.29 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 41.9 t -122.18 95.11 47.56 Favored Pre-proline 0 C--N 1.347 0.458 0 O-C-N 125.165 1.541 . . . . 0.0 107.612 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . 0.419 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 5.6 Cg_exo -67.58 165.76 26.29 Favored 'Trans proline' 0 N--CA 1.443 -1.454 0 O-C-N 123.122 1.064 . . . . 0.0 112.297 176.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -49.87 156.13 3.57 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.224 1.949 . . . . 0.0 115.846 178.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -70.43 128.06 14.9 Favored 'Trans proline' 0 C--N 1.365 1.435 0 N-CA-C 107.011 -1.957 . . . . 0.0 107.011 176.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 13.3 t -73.59 145.95 85.39 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-N 113.92 -1.491 . . . . 0.0 108.511 -177.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -64.35 158.47 48.82 Favored 'Trans proline' 0 C--N 1.358 1.072 0 O-C-N 123.3 1.158 . . . . 0.0 114.535 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.55 118.38 5.48 Favored 'Trans proline' 0 C--N 1.36 1.136 0 N-CA-C 108.453 -1.403 . . . . 0.0 108.453 176.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.11 105.02 14.65 Favored 'General case' 0 C--N 1.353 0.733 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -164.36 49.56 0.12 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 112.37 -2.195 . . . . 0.0 111.517 -178.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.22 133.63 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 113.948 -1.478 . . . . 0.0 107.549 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.622 0 CA-C-N 114.511 -1.222 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 ttt . . . . . 0 N--CA 1.443 -0.79 0 N-CA-C 104.394 -2.447 . . . . 0.0 104.394 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -96.15 149.24 21.85 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 104.301 -2.481 . . . . 0.0 104.301 -179.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.3 157.81 44.16 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 109.936 -3.302 . . . . 0.0 107.395 -179.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.402 ' H ' HG13 ' A' ' 53' ' ' ILE 0.26 20.8 mt -147.19 116.19 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-N 111.963 -2.38 . . . . 0.0 109.305 -176.202 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.85 123.29 20.57 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 118.333 -1.347 . . . . 0.0 108.301 176.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -95.77 -23.56 16.9 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -141.16 163.32 33.28 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 125.355 1.659 . . . . 0.0 106.996 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -65.08 147.01 54.25 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 113.509 -1.678 . . . . 0.0 109.354 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -144.3 136.89 26.79 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 117.38 -1.728 . . . . 0.0 109.662 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -123.97 102.52 7.81 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 112.748 -2.024 . . . . 0.0 110.192 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.62 152.63 0.92 Allowed 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.381 1.086 . . . . 0.0 112.222 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.9 p -114.65 -14.42 12.05 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 111.464 -2.607 . . . . 0.0 114.306 -177.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -150.77 167.52 27.17 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-O 123.326 1.536 . . . . 0.0 110.049 -177.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -54.74 -30.48 56.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 110.018 -3.265 . . . . 0.0 113.907 -178.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 59.3 p30 -91.96 -2.8 56.57 Favored 'General case' 0 C--N 1.353 0.741 0 N-CA-C 114.857 1.429 . . . . 0.0 114.857 -177.571 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -108.84 156.01 20.14 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 125.012 1.445 . . . . 0.0 108.411 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.35 152.73 51.73 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 113.66 -1.609 . . . . 0.0 107.146 179.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 25.0 m -83.0 166.69 18.6 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 112.805 -1.998 . . . . 0.0 113.636 -178.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -164.04 174.25 11.57 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-N 112.4 -2.182 . . . . 0.0 107.887 174.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 11.5 pttt -139.48 122.44 16.69 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 113.191 -1.822 . . . . 0.0 108.497 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -19.43 64.95 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 129.931 3.292 . . . . 0.0 118.29 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 158.87 -12.49 0.21 Allowed Glycine 0 CA--C 1.528 0.858 0 CA-C-N 112.452 -2.158 . . . . 0.0 114.622 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 41.7 m-20 -50.48 147.56 4.42 Favored 'General case' 0 C--N 1.36 1.041 0 CA-C-O 122.52 1.153 . . . . 0.0 113.414 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 70.1 mt -97.35 108.55 21.78 Favored 'Isoleucine or valine' 0 C--N 1.35 0.605 0 N-CA-C 101.618 -3.475 . . . . 0.0 101.618 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.22 157.29 18.46 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 111.683 -2.508 . . . . 0.0 111.57 -176.413 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -106.9 103.82 13.34 Favored 'General case' 0 C--O 1.215 -0.717 0 CA-C-N 110.508 -3.042 . . . . 0.0 109.639 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.3 t -85.52 113.15 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 C-N-CA 116.71 -1.996 . . . . 0.0 106.663 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 tp -91.72 -119.64 0.08 Allowed 'General case' 0 CA--C 1.553 1.08 0 CA-C-N 112.712 -2.04 . . . . 0.0 107.702 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -67.39 174.82 3.08 Favored 'General case' 0 C--N 1.355 0.844 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 -178.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 177.67 49.86 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 112.596 -2.093 . . . . 0.0 110.642 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -85.39 111.97 20.42 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 112.506 -2.133 . . . . 0.0 109.34 -178.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 87.31 -48.57 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 110.964 -2.834 . . . . 0.0 114.978 175.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.0 p30 -57.58 147.29 27.53 Favored 'General case' 0 C--N 1.357 0.928 0 CA-C-O 122.568 1.175 . . . . 0.0 111.325 -178.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -141.39 54.95 1.53 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 112.69 -2.05 . . . . 0.0 107.804 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 -179.31 -15.01 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 111.844 -2.435 . . . . 0.0 113.287 -177.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -136.25 155.76 49.64 Favored 'General case' 0 C--N 1.351 0.673 0 O-C-N 124.15 0.906 . . . . 0.0 108.57 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -136.29 149.7 48.56 Favored 'General case' 0 C--N 1.351 0.663 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 176.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -98.25 120.6 38.93 Favored 'General case' 0 C--N 1.347 0.487 0 N-CA-C 102.101 -3.296 . . . . 0.0 102.101 177.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.99 172.61 12.6 Favored 'General case' 0 C--N 1.348 0.524 0 C-N-CA 118.074 -1.45 . . . . 0.0 112.062 -175.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -125.6 142.04 51.71 Favored 'General case' 0 C--N 1.356 0.861 0 CA-C-N 112.532 -2.122 . . . . 0.0 112.104 -177.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.2 mt -158.88 125.17 4.56 Favored 'General case' 0 C--O 1.222 -0.371 1 CA-C-N 108.337 -4.029 . . . . 0.0 115.041 -179.573 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.341 0.0 OUTLIER 61.06 28.98 18.67 Favored 'General case' 0 C--N 1.358 0.943 0 N-CA-C 119.557 3.169 . . . . 0.0 119.557 171.18 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 68.67 22.97 75.53 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 119.694 -1.241 . . . . 0.0 111.909 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -131.08 142.37 50.27 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 111.126 -2.537 . . . . 0.0 105.37 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -139.67 140.7 36.95 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 113.31 -1.768 . . . . 0.0 107.589 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -177.19 176.84 48.23 Favored Glycine 0 C--N 1.346 1.089 0 C-N-CA 118.651 -1.738 . . . . 0.0 111.901 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -77.92 141.99 38.69 Favored 'General case' 0 C--N 1.35 0.606 0 CA-C-N 112.732 -1.734 . . . . 0.0 109.057 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 22.9 pt -142.12 148.17 47.2 Favored Pre-proline 0 N--CA 1.45 -0.454 0 CA-C-N 110.903 -2.862 . . . . 0.0 106.033 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -77.68 138.29 16.93 Favored 'Trans proline' 0 C--N 1.363 1.337 0 N-CA-C 114.066 0.756 . . . . 0.0 114.066 -177.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -33.51 71.89 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 117.315 -1.754 . . . . 0.0 112.549 -177.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.32 0.6 OUTLIER -70.01 -8.45 49.22 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 116.833 -1.947 . . . . 0.0 114.133 179.092 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -93.01 -13.19 29.01 Favored 'General case' 0 CA--C 1.559 1.308 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 176.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.491 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -128.88 170.62 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 CA-C-O 122.572 1.177 . . . . 0.0 109.736 179.606 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.491 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 2.8 tp10 -123.66 145.19 49.14 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 103.732 -2.692 . . . . 0.0 103.732 176.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . 0.275 38.5 mtm -85.17 -93.83 0.08 Allowed 'General case' 0 C--N 1.342 0.266 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -176.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm 71.05 94.46 0.05 OUTLIER Pre-proline 0 CA--C 1.563 1.461 0 CA-C-N 111.012 -2.813 . . . . 0.0 110.696 -176.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo . . . . . 0 CA--C 1.559 1.731 0 C-N-CA 121.769 1.646 . . . . 0.0 111.022 177.274 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.286 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 7.3 p -91.76 105.74 14.49 Favored Pre-proline 0 CA--C 1.539 0.557 0 O-C-N 126.234 2.209 . . . . 0.0 106.138 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -65.95 157.86 57.11 Favored 'Trans proline' 0 CA--C 1.554 1.495 0 N-CA-C 114.204 0.809 . . . . 0.0 114.204 177.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -54.71 160.94 6.63 Favored 'Trans proline' 0 C--N 1.368 1.575 0 C-N-CA 123.358 2.705 . . . . 0.0 116.997 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -73.51 127.93 12.23 Favored 'Trans proline' 0 C--N 1.371 1.757 0 N-CA-C 105.561 -2.515 . . . . 0.0 105.561 174.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.441 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 2.7 t -73.19 147.22 87.79 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-N 114.026 -1.443 . . . . 0.0 108.868 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . 0.441 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 13.4 Cg_exo -67.49 156.29 66.73 Favored 'Trans proline' 0 N--CA 1.45 -1.073 0 N-CA-C 115.69 1.381 . . . . 0.0 115.69 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -65.78 123.1 10.88 Favored 'Trans proline' 0 C--N 1.365 1.438 0 N-CA-C 107.347 -1.828 . . . . 0.0 107.347 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.84 84.74 2.04 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 122.989 1.376 . . . . 0.0 110.831 -177.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -174.35 66.47 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 112.152 -2.294 . . . . 0.0 109.727 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.273 0.1 OUTLIER -105.55 21.06 17.85 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 113.319 -1.764 . . . . 0.0 112.432 -179.222 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.344 0.345 0 CA-C-N 114.561 -1.2 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.448 -0.554 0 CA-C-O 122.471 1.129 . . . . 0.0 110.15 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -108.39 142.4 38.8 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 111.668 -2.515 . . . . 0.0 104.477 -179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.59 160.57 38.4 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 110.746 -2.934 . . . . 0.0 108.323 -176.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.251 44.3 mt -146.99 115.49 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.848 0 CA-C-N 109.931 -3.304 . . . . 0.0 109.423 -176.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.57 125.16 25.65 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 176.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.2 mtmt -95.45 -23.56 17.07 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 114.591 -1.186 . . . . 0.0 113.635 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -140.75 169.06 18.34 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 107.057 -1.46 . . . . 0.0 107.057 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -68.94 150.79 47.32 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.89 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -147.64 130.65 16.27 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 116.712 -1.995 . . . . 0.0 109.476 175.419 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.07 103.2 8.15 Favored 'General case' 0 CA--C 1.556 1.198 0 N-CA-C 106.088 -1.819 . . . . 0.0 106.088 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.82 154.38 0.33 Allowed 'General case' 0 C--N 1.375 1.696 0 O-C-N 124.717 1.261 . . . . 0.0 113.787 -178.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.0 p -111.66 -15.52 13.43 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-N 111.772 -2.467 . . . . 0.0 112.167 -177.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.42 163.12 40.16 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 123.123 1.439 . . . . 0.0 110.052 -178.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -51.71 -34.24 37.93 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 110.733 -2.94 . . . . 0.0 115.263 -176.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -89.1 0.1 56.99 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 118.383 -1.327 . . . . 0.0 114.501 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.06 159.5 16.25 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 113.013 -1.903 . . . . 0.0 106.236 176.661 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -136.68 155.41 49.91 Favored 'General case' 0 CA--C 1.562 1.428 0 C-N-CA 118.303 -1.359 . . . . 0.0 108.049 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.8 m -83.67 163.78 20.08 Favored 'General case' 0 CA--C 1.568 1.645 0 CA-C-N 113.419 -1.719 . . . . 0.0 113.021 -177.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -164.71 172.7 12.73 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 111.074 -2.785 . . . . 0.0 107.457 173.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -132.65 151.64 51.9 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 104.621 -2.363 . . . . 0.0 104.621 178.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.5 ttp180 -46.89 104.48 0.05 Allowed 'General case' 0 CA--C 1.556 1.173 0 CA-C-N 112.994 -1.912 . . . . 0.0 112.381 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.32 -23.22 4.61 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-N 113.446 -1.706 . . . . 0.0 115.743 178.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 47.8 m-20 -48.57 147.65 2.4 Favored 'General case' 0 C--N 1.364 1.239 0 N-CA-C 116.274 1.953 . . . . 0.0 116.274 -177.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.2 mp -100.87 117.05 45.55 Favored 'Isoleucine or valine' 0 C--N 1.346 0.416 0 CA-C-N 111.772 -2.467 . . . . 0.0 104.922 176.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 4.6 mp -110.67 159.88 17.19 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 122.748 1.261 . . . . 0.0 112.707 -179.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.0 108.14 19.2 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-N 110.78 -2.918 . . . . 0.0 105.633 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 2.7 t -87.13 102.3 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 111.827 -3.949 . . . . 0.0 110.147 -174.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.9 tt -91.34 97.18 10.94 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 117.4 -1.72 . . . . 0.0 106.904 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 69.11 154.47 0.12 Allowed 'General case' 0 CA--C 1.55 0.956 0 CA-C-N 112.962 -1.927 . . . . 0.0 110.923 -178.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -166.87 59.58 0.09 Allowed 'General case' 0 CA--C 1.557 1.229 0 CA-C-N 111.436 -2.62 . . . . 0.0 112.927 -177.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -125.97 -28.36 3.19 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 118.107 2.632 . . . . 0.0 118.107 -178.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.9 t -70.41 -8.75 53.22 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 109.972 -3.286 . . . . 0.0 116.184 -175.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -167.1 129.54 1.72 Allowed 'General case' 0 C--N 1.349 0.57 0 CA-C-O 122.759 1.266 . . . . 0.0 109.983 -177.417 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -72.35 -31.01 65.25 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 112.853 -1.976 . . . . 0.0 115.314 -176.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -96.7 -18.52 19.61 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 131.62 3.968 . . . . 0.0 112.845 -174.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -123.38 152.87 41.1 Favored 'General case' 0 CA--C 1.553 1.074 0 O-C-N 124.338 1.024 . . . . 0.0 109.389 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -134.21 144.64 48.57 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 104.992 -2.225 . . . . 0.0 104.992 177.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -101.18 124.7 47.29 Favored 'General case' 0 C--N 1.358 0.948 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 178.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -144.34 169.14 18.49 Favored 'General case' 0 C--N 1.357 0.911 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -109.6 136.16 49.42 Favored 'General case' 0 C--N 1.367 1.342 0 CA-C-N 113.79 -1.55 . . . . 0.0 111.338 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.304 11.2 mt -162.49 139.76 8.12 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 110.297 -3.138 . . . . 0.0 113.577 177.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 58.39 28.94 17.52 Favored 'General case' 0 C--N 1.353 0.737 0 CA-C-N 110.829 -2.896 . . . . 0.0 115.48 169.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.07 18.19 78.87 Favored Glycine 0 CA--C 1.541 1.698 0 CA-C-N 114.647 -1.16 . . . . 0.0 114.199 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -137.37 166.56 23.52 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 124.593 1.157 . . . . 0.0 107.937 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -142.68 136.49 29.09 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 112.33 -2.214 . . . . 0.0 106.423 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -174.14 175.36 46.6 Favored Glycine 0 C--N 1.347 1.154 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.144 -178.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -78.78 147.83 33.17 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 122.927 1.346 . . . . 0.0 110.25 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 9.0 pt -142.16 147.85 45.72 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-N 111.54 -2.573 . . . . 0.0 106.162 178.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -75.41 142.43 26.64 Favored 'Trans proline' 0 C--N 1.362 1.275 0 N-CA-C 114.498 0.922 . . . . 0.0 114.498 -177.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.484 ' HZ1' ' HB2' ' A' ' 50' ' ' LYS . 0.0 OUTLIER -70.53 -30.92 67.79 Favored 'General case' 0 C--N 1.369 1.425 0 C-N-CA 113.345 -3.342 . . . . 0.0 113.493 -179.719 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -69.49 -9.54 54.2 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 116.161 -2.216 . . . . 0.0 114.726 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -93.04 -12.0 31.67 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.346 178.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.482 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -128.62 171.66 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 178.359 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.482 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 85.5 tt0 -132.19 132.96 43.65 Favored 'General case' 0 C--N 1.355 0.817 0 CA-C-N 112.53 -2.123 . . . . 0.0 106.16 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -85.05 168.89 14.49 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 113.369 -1.741 . . . . 0.0 110.004 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -153.37 83.77 4.47 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 112.046 -2.343 . . . . 0.0 109.637 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo . . . . . 0 C--N 1.37 1.678 0 C-N-CA 121.914 1.743 . . . . 0.0 108.878 176.197 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.334 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 6.0 m -68.82 116.58 42.63 Favored Pre-proline 0 N--CA 1.433 -1.313 0 O-C-N 125.238 1.586 . . . . 0.0 109.442 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -69.52 154.42 68.7 Favored 'Trans proline' 0 N--CA 1.431 -2.156 0 N-CA-C 115.402 1.27 . . . . 0.0 115.402 178.546 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -54.81 156.75 14.3 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.663 2.242 . . . . 0.0 117.03 179.065 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -69.54 123.45 10.18 Favored 'Trans proline' 0 C--N 1.365 1.407 0 N-CA-C 105.345 -2.598 . . . . 0.0 105.345 174.026 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.439 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 3.3 t -72.05 150.39 92.47 Favored Pre-proline 0 C--N 1.343 0.296 0 CA-C-N 113.619 -1.628 . . . . 0.0 108.665 -178.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . 0.439 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 19.5 Cg_exo -69.99 155.87 64.13 Favored 'Trans proline' 0 N--CA 1.445 -1.328 0 O-C-N 123.473 1.249 . . . . 0.0 112.297 176.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -72.52 118.29 5.52 Favored 'Trans proline' 0 CA--C 1.547 1.16 0 N-CA-C 107.253 -1.864 . . . . 0.0 107.253 175.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.05 162.23 20.42 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 178.692 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 116.76 63.94 0.0 OUTLIER 'General case' 0 C--N 1.355 0.832 0 C-N-CA 130.735 3.614 . . . . 0.0 108.22 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -170.11 142.98 2.38 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.261 -1.336 . . . . 0.0 107.44 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.305 0 CA-C-N 113.978 -1.464 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.222 -0.363 0 N-CA-C 106.387 -1.708 . . . . 0.0 106.387 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . 0.278 1.2 mm-40 -89.89 -81.32 0.29 Allowed 'General case' 0 CA--C 1.555 1.138 0 CA-C-O 123.835 1.779 . . . . 0.0 112.708 -178.469 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.44 ' CB ' HD12 ' A' ' 53' ' ' ILE . . . 80.53 167.23 0.16 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 109.346 -3.57 . . . . 0.0 110.191 -176.631 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.428 12.0 mt -149.61 130.81 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 111.336 -2.665 . . . . 0.0 111.949 -167.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.432 ' HA ' ' HB ' ' A' ' 53' ' ' ILE . . . -65.84 126.3 28.08 Favored 'General case' 0 CA--C 1.556 1.174 0 CA-C-N 113.589 -1.641 . . . . 0.0 108.742 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mmpt? -98.02 -28.03 13.96 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 114.047 -1.433 . . . . 0.0 114.155 -178.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -141.38 166.05 25.82 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 106.168 -1.79 . . . . 0.0 106.168 -179.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.88 147.8 52.76 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 124.338 1.024 . . . . 0.0 109.451 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -146.69 132.78 19.28 Favored 'General case' 0 C--N 1.354 0.798 0 C-N-CA 118.043 -1.463 . . . . 0.0 109.471 176.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.9 mmtm -122.29 113.07 18.92 Favored 'General case' 0 C--N 1.346 0.431 0 CA-C-N 113.712 -1.585 . . . . 0.0 107.603 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.03 149.98 0.84 Allowed 'General case' 0 C--N 1.359 1.01 0 O-C-N 125.639 1.837 . . . . 0.0 112.468 -177.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.4 p -113.68 -19.4 11.59 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 111.054 -2.794 . . . . 0.0 113.557 -177.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.81 167.79 27.87 Favored 'General case' 0 C--N 1.354 0.777 0 CA-C-O 123.776 1.751 . . . . 0.0 111.965 -178.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -43.02 -39.67 2.75 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 109.824 -3.353 . . . . 0.0 115.393 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 49.2 p-10 -87.74 -0.81 57.41 Favored 'General case' 0 C--N 1.349 0.573 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 -175.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -106.39 159.77 15.89 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.714 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.06 150.5 50.44 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 112.017 -2.356 . . . . 0.0 106.213 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 10.2 m -84.07 169.1 15.26 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 123.709 1.718 . . . . 0.0 113.721 -177.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -162.69 178.99 8.02 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-N 111.712 -2.495 . . . . 0.0 108.377 171.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.49 ' HZ3' HD22 ' A' ' 42' ' ' ASN . 2.3 mtmt -139.33 135.18 33.5 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 103.836 -2.653 . . . . 0.0 103.836 -179.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -42.28 97.95 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.779 0 O-C-N 125.555 1.784 . . . . 0.0 113.489 -177.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 138.31 -22.81 3.04 Favored Glycine 0 C--N 1.35 1.344 0 CA-C-N 113.209 -1.814 . . . . 0.0 115.33 178.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -47.02 143.3 3.08 Favored 'General case' 0 C--N 1.364 1.214 0 CA-C-O 121.547 0.689 . . . . 0.0 112.049 -179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mt -96.87 124.96 49.95 Favored 'Isoleucine or valine' 0 C--N 1.35 0.611 0 N-CA-C 103.498 -2.778 . . . . 0.0 103.498 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -111.07 157.8 19.57 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 125.201 1.563 . . . . 0.0 111.711 -175.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -118.99 103.26 9.41 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 128.74 3.775 . . . . 0.0 108.605 176.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.5 t -85.19 103.33 12.17 Favored 'Isoleucine or valine' 0 C--N 1.353 0.759 0 C-N-CA 116.139 -2.224 . . . . 0.0 109.744 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -92.85 96.99 10.47 Favored 'General case' 0 C--N 1.355 0.806 0 CA-C-N 112.826 -1.988 . . . . 0.0 105.89 177.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.3 t30 71.72 161.49 0.24 Allowed 'General case' 0 CA--C 1.558 1.27 0 CA-C-N 113.235 -1.802 . . . . 0.0 111.808 -179.056 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -168.46 96.0 0.39 Allowed 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 111.441 -2.618 . . . . 0.0 106.425 -178.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -174.33 58.3 0.02 OUTLIER 'General case' 0 C--N 1.347 0.494 0 CA-C-O 123.768 1.747 . . . . 0.0 108.12 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.7 t -121.71 -65.99 1.08 Allowed 'General case' 0 C--O 1.222 -0.344 0 CA-C-N 110.293 -3.14 . . . . 0.0 108.129 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -161.0 120.54 2.63 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-N 113.635 -1.62 . . . . 0.0 106.952 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.4 pm0 -62.88 109.63 1.51 Allowed 'General case' 0 C--N 1.355 0.805 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 -178.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 147.13 -16.59 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 128.513 2.725 . . . . 0.0 112.876 -174.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 55.6 m95 -135.85 164.01 28.91 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -178.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -137.47 145.9 43.63 Favored 'General case' 0 C--N 1.358 0.936 0 O-C-N 124.392 1.058 . . . . 0.0 109.198 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.46 ' CB ' ' HZ1' ' A' ' 38' ' ' LYS . 0.5 OUTLIER -101.73 115.23 30.08 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 176.453 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.75 172.12 13.24 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 118.936 -1.106 . . . . 0.0 112.225 -176.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -108.79 130.35 55.39 Favored 'General case' 0 C--N 1.357 0.902 0 CA-C-N 113.566 -1.652 . . . . 0.0 111.789 -178.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.274 13.6 mt -163.15 146.29 10.57 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-N 110.409 -3.087 . . . . 0.0 115.501 178.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.49 HD22 ' HZ3' ' A' ' 20' ' ' LYS . 0.7 OUTLIER 57.35 29.03 16.19 Favored 'General case' 0 C--N 1.358 0.969 0 CA-C-N 111.374 -2.648 . . . . 0.0 114.929 169.299 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 71.83 21.15 79.03 Favored Glycine 0 CA--C 1.542 1.757 0 O-C-N 124.433 1.083 . . . . 0.0 114.679 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -138.16 169.59 17.52 Favored 'General case' 0 C--N 1.35 0.606 0 C-N-CA 125.532 1.533 . . . . 0.0 108.45 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -142.27 131.19 22.99 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 112.439 -2.164 . . . . 0.0 105.921 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -174.91 -179.22 45.35 Favored Glycine 0 C--N 1.344 1.023 0 C-N-CA 118.091 -2.004 . . . . 0.0 112.787 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -78.17 145.04 35.86 Favored 'General case' 0 C--N 1.353 0.734 0 CA-C-N 113.445 -1.378 . . . . 0.0 111.475 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 27.0 pt -144.86 148.13 37.9 Favored Pre-proline 0 C--N 1.351 0.634 0 CA-C-N 112.362 -2.199 . . . . 0.0 108.465 178.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -78.42 140.74 17.38 Favored 'Trans proline' 0 C--N 1.366 1.498 0 CA-C-N 119.472 0.847 . . . . 0.0 114.289 -179.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.3 ptmm? -70.54 -35.57 73.2 Favored 'General case' 0 C--N 1.362 1.125 0 C-N-CA 116.344 -2.142 . . . . 0.0 113.106 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.268 0.7 OUTLIER -66.76 -9.86 41.2 Favored 'General case' 0 C--N 1.364 1.209 0 C-N-CA 114.276 -2.969 . . . . 0.0 114.57 -179.525 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -92.45 -12.6 31.66 Favored 'General case' 0 C--N 1.359 0.983 0 CA-C-O 117.446 -1.264 . . . . 0.0 111.589 178.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.44 HD12 ' CB ' ' A' ' 3' ' ' ALA . 0.0 OUTLIER -135.52 155.12 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 CA-C-N 119.07 0.85 . . . . 0.0 110.466 178.045 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -115.46 146.62 41.48 Favored 'General case' 0 C--N 1.361 1.069 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 177.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -85.26 159.52 20.05 Favored 'General case' 0 C--N 1.346 0.438 0 CA-C-N 113.157 -1.838 . . . . 0.0 111.91 -178.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 21.2 mmtt -151.27 83.53 5.48 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 112.769 -2.014 . . . . 0.0 108.872 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo . . . . . 0 C--N 1.369 1.608 0 C-N-CA 122.011 1.807 . . . . 0.0 108.435 176.277 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.278 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 96.6 t -97.35 108.62 45.74 Favored Pre-proline 0 C--N 1.349 0.576 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -62.75 159.71 36.14 Favored 'Trans proline' 0 CA--C 1.551 1.331 0 O-C-N 123.16 1.084 . . . . 0.0 114.155 178.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -54.18 158.71 8.92 Favored 'Trans proline' 0 C--N 1.358 1.07 0 N-CA-C 117.1 1.923 . . . . 0.0 117.1 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_endo -70.65 123.3 9.68 Favored 'Trans proline' 0 C--N 1.36 1.163 0 N-CA-C 104.91 -2.765 . . . . 0.0 104.91 173.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.477 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.3 t -63.81 148.39 94.72 Favored Pre-proline 0 C--N 1.35 0.625 0 O-C-N 124.84 1.338 . . . . 0.0 109.205 -178.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . 0.477 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 23.2 Cg_exo -62.61 153.48 71.46 Favored 'Trans proline' 0 N--CA 1.447 -1.221 0 O-C-N 122.93 0.963 . . . . 0.0 114.253 178.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -69.62 112.8 3.15 Favored 'Trans proline' 0 C--N 1.363 1.338 0 N-CA-C 106.648 -2.097 . . . . 0.0 106.648 176.115 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.25 148.94 24.1 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-N 113.009 -1.905 . . . . 0.0 106.702 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 72.26 70.38 0.15 Allowed 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.62 1.2 . . . . 0.0 109.117 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -16.24 89.65 0.01 OUTLIER 'General case' 0 C--N 1.36 1.024 0 C-N-CA 127.634 2.373 . . . . 0.0 112.775 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.067 0 CA-C-N 112.835 -1.984 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.159 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -107.04 -5.65 17.95 Favored 'General case' 0 C--N 1.354 0.767 0 O-C-N 125.669 1.856 . . . . 0.0 115.56 -176.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 51.31 -172.86 0.02 OUTLIER 'General case' 0 C--O 1.221 -0.398 0 CA-C-O 123.326 1.536 . . . . 0.0 113.881 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.407 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 2.0 mt -157.42 -177.3 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 100.425 -3.917 . . . . 0.0 100.425 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -165.82 108.87 0.79 Allowed 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 102.389 -3.189 . . . . 0.0 102.389 177.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.9 mtmp? -90.01 -15.19 32.39 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 111.122 -2.763 . . . . 0.0 116.504 -175.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -142.35 164.79 29.19 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 179.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -71.37 152.88 42.75 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 117.17 -1.812 . . . . 0.0 108.419 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -142.68 142.69 32.08 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.5 tptt -134.83 103.79 5.75 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 112.548 -2.115 . . . . 0.0 108.164 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.25 158.6 0.1 Allowed 'General case' 0 N--CA 1.482 1.15 0 CA-C-O 122.944 1.354 . . . . 0.0 114.199 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.0 p -119.09 -15.28 9.26 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 110.335 -3.121 . . . . 0.0 112.669 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.16 170.08 21.4 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-O 123.316 1.531 . . . . 0.0 113.366 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -50.63 -34.79 27.56 Favored 'General case' 0 CA--C 1.555 1.159 0 CA-C-N 109.948 -3.296 . . . . 0.0 114.337 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -92.19 -5.0 53.38 Favored 'General case' 0 C--N 1.355 0.828 0 N-CA-C 115.551 1.686 . . . . 0.0 115.551 -176.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -108.86 156.5 19.59 Favored 'General case' 0 C--O 1.222 -0.377 0 O-C-N 124.826 1.329 . . . . 0.0 108.936 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . 0.265 2.9 pp -137.79 156.04 48.38 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 112.718 -2.037 . . . . 0.0 111.121 177.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 m -84.42 170.54 13.45 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 111.913 -2.403 . . . . 0.0 115.484 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -163.53 175.56 10.58 Favored 'General case' 0 C--N 1.352 0.699 0 CA-C-N 109.461 -3.518 . . . . 0.0 107.586 175.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mtmt -136.53 143.18 43.58 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 112.777 -2.01 . . . . 0.0 106.388 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -44.08 98.05 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.28 0 O-C-N 126.247 2.217 . . . . 0.0 112.957 -178.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 140.34 -23.24 2.71 Favored Glycine 0 CA--C 1.543 1.81 0 CA-C-N 113.428 -1.714 . . . . 0.0 114.992 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -51.22 145.84 7.48 Favored 'General case' 0 C--N 1.363 1.154 0 N-CA-C 116.099 1.888 . . . . 0.0 116.099 -176.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -104.34 112.77 39.24 Favored 'Isoleucine or valine' 0 C--N 1.346 0.456 0 N-CA-C 102.188 -3.264 . . . . 0.0 102.188 173.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 6.3 mp -104.95 167.76 9.5 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 116.146 -2.222 . . . . 0.0 112.923 -176.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.72 109.15 20.97 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 176.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 71.1 t -87.78 97.02 6.19 Favored 'Isoleucine or valine' 0 C--N 1.357 0.927 0 C-N-CA 114.888 -2.725 . . . . 0.0 107.874 -177.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -93.15 98.53 11.36 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 111.955 -2.384 . . . . 0.0 107.484 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.9 m120 66.99 147.98 0.05 OUTLIER 'General case' 0 CA--C 1.561 1.385 0 CA-C-N 112.636 -2.075 . . . . 0.0 111.82 -179.058 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -150.95 91.03 1.66 Allowed 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 110.875 -2.875 . . . . 0.0 108.912 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -169.78 92.86 0.24 Allowed 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 9.0 p -175.91 -46.18 0.01 OUTLIER 'General case' 0 C--N 1.352 0.687 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.911 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -160.66 110.83 1.76 Allowed 'General case' 0 C--N 1.359 0.999 0 C-N-CA 119.047 -1.061 . . . . 0.0 109.618 -178.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -64.46 108.77 1.74 Allowed 'General case' 0 C--N 1.355 0.827 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.4 m120 142.04 -14.43 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.589 0 O-C-N 126.981 2.675 . . . . 0.0 109.913 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.5 m95 -136.49 161.31 36.21 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.776 0.798 . . . . 0.0 110.85 -177.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -133.71 150.92 51.52 Favored 'General case' 0 C--N 1.355 0.819 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.7 tttt -102.68 119.16 38.35 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 176.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.0 170.11 16.34 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 118.273 -1.371 . . . . 0.0 113.401 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -110.57 138.55 46.82 Favored 'General case' 0 C--N 1.362 1.116 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.64 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.281 12.1 mt -160.02 138.24 10.19 Favored 'General case' 0 CA--C 1.502 -0.88 0 CA-C-N 112.709 -2.041 . . . . 0.0 112.977 179.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 56.92 21.9 6.62 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 116.191 -2.203 . . . . 0.0 115.658 168.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 92.51 -9.06 76.58 Favored Glycine 0 CA--C 1.546 1.988 0 N-CA-C 115.37 0.908 . . . . 0.0 115.37 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.9 mttp -113.25 170.05 8.5 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -140.94 131.17 24.92 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 113.119 -1.855 . . . . 0.0 106.303 -179.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.96 173.37 45.57 Favored Glycine 0 C--N 1.349 1.267 0 C-N-CA 116.401 -2.809 . . . . 0.0 113.217 -177.507 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -76.77 139.34 40.37 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 123.653 1.692 . . . . 0.0 109.511 -179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -139.99 143.1 32.93 Favored Pre-proline 0 C--N 1.347 0.498 0 CA-C-N 110.8 -2.909 . . . . 0.0 106.462 179.471 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -74.76 143.75 30.31 Favored 'Trans proline' 0 C--N 1.361 1.216 0 N-CA-C 115.07 1.142 . . . . 0.0 115.07 -175.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 15.6 pttt -71.9 -33.85 68.65 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 116.072 -2.251 . . . . 0.0 113.947 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -62.11 -19.66 63.23 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-N 115.077 -0.965 . . . . 0.0 113.144 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -93.35 -13.34 28.22 Favored 'General case' 0 CA--C 1.566 1.591 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.494 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -126.86 173.25 12.79 Favored 'Isoleucine or valine' 0 C--N 1.368 1.401 0 CA-C-O 121.808 0.813 . . . . 0.0 111.115 -178.338 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.494 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 0.2 OUTLIER -131.41 137.15 48.55 Favored 'General case' 0 C--N 1.358 0.971 0 CA-C-N 112.691 -2.05 . . . . 0.0 107.494 178.163 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 62.2 mtm -84.57 157.83 21.1 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 20.7 mmtp -152.12 95.14 3.2 Favored Pre-proline 0 CA--C 1.545 0.765 0 CA-C-N 113.961 -1.472 . . . . 0.0 111.915 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 C--N 1.372 1.774 0 C-N-CA 122.001 1.8 . . . . 0.0 112.095 176.538 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.304 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 74.5 t -122.4 93.34 48.56 Favored Pre-proline 0 C--N 1.346 0.427 0 O-C-N 125.218 1.574 . . . . 0.0 106.895 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -64.39 159.95 41.54 Favored 'Trans proline' 0 CA--C 1.573 2.431 0 N-CA-C 116.069 1.527 . . . . 0.0 116.069 177.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -52.6 156.35 8.87 Favored 'Trans proline' 0 C--N 1.373 1.831 0 C-N-CA 123.953 3.102 . . . . 0.0 116.785 178.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -74.67 120.34 6.12 Favored 'Trans proline' 0 C--N 1.358 1.037 0 N-CA-C 106.287 -2.236 . . . . 0.0 106.287 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 2.5 t -66.02 149.95 97.14 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-N 113.555 -1.657 . . . . 0.0 109.908 -178.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 15.7 Cg_exo -71.26 159.95 50.35 Favored 'Trans proline' 0 C--N 1.359 1.099 0 N-CA-C 116.749 1.788 . . . . 0.0 116.749 178.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -75.94 118.69 5.11 Favored 'Trans proline' 0 C--N 1.359 1.098 0 N-CA-C 107.157 -1.901 . . . . 0.0 107.157 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.416 ' H ' ' NE ' ' B' ' 8' ' ' ARG . 0.0 OUTLIER -98.32 156.58 16.66 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 178.22 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 71.31 69.69 0.17 Allowed 'General case' 0 C--N 1.345 0.406 0 CA-C-N 112.02 -2.354 . . . . 0.0 108.624 -178.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 42.6 mmm-85 3.2 79.17 0.0 OUTLIER 'General case' 0 C--N 1.354 0.766 0 C-N-CA 129.491 3.116 . . . . 0.0 113.324 178.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.097 0 CA-C-N 110.054 -3.248 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.538 ' HB3' ' HZ2' ' A' ' 56' ' ' LYS . 0.5 OUTLIER -111.36 148.68 32.47 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 111.976 -2.375 . . . . 0.0 106.199 -177.906 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -138.51 170.56 15.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 111.587 -2.551 . . . . 0.0 109.648 -179.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.44 ' H ' HG13 ' A' ' 53' ' ' ILE . 11.1 mt -156.63 110.02 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.806 0 CA-C-N 111.286 -2.688 . . . . 0.0 109.408 -176.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.17 122.13 17.64 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 116.073 -2.251 . . . . 0.0 109.375 178.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -96.16 -23.01 16.94 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -179.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 17.6 m-85 -140.01 160.57 39.64 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 179.7 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.2 151.22 47.93 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.042 -1.435 . . . . 0.0 109.561 -178.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -143.77 139.3 29.33 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 176.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? -126.45 96.88 4.83 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-N 111.964 -2.38 . . . . 0.0 109.677 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -45.22 149.51 0.5 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 122.192 0.996 . . . . 0.0 113.387 -178.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.8 t -123.92 2.32 8.72 Favored 'General case' 0 C--N 1.354 0.772 0 CA-C-N 111.309 -2.678 . . . . 0.0 114.855 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.4 163.84 39.21 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 118.399 -1.32 . . . . 0.0 110.363 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -50.6 -39.17 49.23 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-N 111.609 -2.541 . . . . 0.0 113.264 -178.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.6 p30 -88.9 1.07 55.97 Favored 'General case' 0 C--N 1.354 0.778 0 N-CA-C 116.421 2.008 . . . . 0.0 116.421 -176.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -113.66 153.14 29.42 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 124.633 1.208 . . . . 0.0 109.382 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -136.39 158.76 43.66 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 113.47 -1.695 . . . . 0.0 110.793 178.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.7 m -84.2 170.83 13.36 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 116.933 2.197 . . . . 0.0 116.933 -177.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -163.83 170.55 16.7 Favored 'General case' 0 C--N 1.355 0.824 0 CA-C-N 109.07 -3.695 . . . . 0.0 109.863 176.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -135.45 118.29 16.2 Favored 'General case' 0 C--N 1.354 0.787 0 CA-C-N 112.57 -2.105 . . . . 0.0 110.57 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -14.51 74.48 0.0 OUTLIER 'General case' 0 CA--C 1.559 1.291 0 N-CA-C 116.837 2.162 . . . . 0.0 116.837 178.149 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 150.78 -16.74 0.94 Allowed Glycine 0 CA--C 1.537 1.427 0 CA-C-N 111.847 -2.433 . . . . 0.0 116.0 179.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -50.96 151.59 2.5 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -178.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.3 pt -98.71 108.68 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.393 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 3.0 mp -104.75 157.36 17.25 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 116.443 -2.103 . . . . 0.0 110.804 -177.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -105.0 106.54 17.07 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 110.922 -2.854 . . . . 0.0 108.026 177.399 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 86.6 t -86.7 111.08 21.01 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 C-N-CA 115.216 -2.594 . . . . 0.0 106.099 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -96.22 -16.16 21.59 Favored 'General case' 0 C--N 1.352 0.708 0 CA-C-N 112.592 -2.095 . . . . 0.0 113.844 -176.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -168.33 112.0 0.6 Allowed 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 115.599 -2.441 . . . . 0.0 113.052 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -97.49 176.8 5.73 Favored 'General case' 0 C--N 1.356 0.856 0 CA-C-N 114.2 -1.364 . . . . 0.0 108.619 177.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 67.62 81.43 0.19 Allowed 'General case' 0 C--N 1.359 1.002 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 42.5 t -166.63 -29.71 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 112.972 -1.922 . . . . 0.0 112.267 179.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -172.96 69.79 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 178.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -31.7 78.96 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 131.284 3.834 . . . . 0.0 111.115 -177.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 22.3 m-20 156.76 -0.83 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.441 0 O-C-N 127.238 2.836 . . . . 0.0 112.565 -176.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -135.39 169.58 17.27 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 122.357 1.075 . . . . 0.0 109.66 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -137.97 139.62 39.8 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 113.235 -1.802 . . . . 0.0 106.715 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -98.76 115.52 28.94 Favored 'General case' 0 C--N 1.354 0.772 0 N-CA-C 100.393 -3.928 . . . . 0.0 100.393 176.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.49 176.23 8.89 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 125.044 1.465 . . . . 0.0 113.417 -173.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -120.02 148.32 43.71 Favored 'General case' 0 C--N 1.362 1.12 0 O-C-N 125.064 1.478 . . . . 0.0 111.118 -179.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.302 9.4 mt -161.94 138.93 8.33 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-N 110.465 -3.061 . . . . 0.0 111.953 179.342 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.63 29.06 12.92 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 115.688 -2.405 . . . . 0.0 116.43 168.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.94 10.63 85.42 Favored Glycine 0 CA--C 1.546 2.019 0 C-N-CA 118.662 -1.732 . . . . 0.0 115.013 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -135.73 163.01 31.15 Favored 'General case' 0 C--O 1.217 -0.629 0 C-N-CA 124.597 1.159 . . . . 0.0 107.942 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -141.41 139.73 33.51 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.419 -178.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -170.96 176.09 44.46 Favored Glycine 0 C--N 1.347 1.161 0 C-N-CA 118.477 -1.82 . . . . 0.0 110.591 -177.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -77.3 144.8 37.83 Favored 'General case' 0 C--N 1.354 0.801 0 CA-C-O 122.522 1.153 . . . . 0.0 110.708 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.3 pt -144.42 139.29 15.48 Favored Pre-proline 0 C--N 1.352 0.677 0 CA-C-N 112.392 -2.185 . . . . 0.0 107.819 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -72.02 148.66 51.38 Favored 'Trans proline' 0 C--N 1.363 1.336 0 CA-C-N 120.018 1.042 . . . . 0.0 114.197 -176.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -70.22 -41.69 73.29 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 115.136 -2.626 . . . . 0.0 111.395 -178.422 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.1 p-10 -57.46 -18.68 19.65 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 -179.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.9 m-85 -91.63 -7.81 48.98 Favored 'General case' 0 C--N 1.355 0.843 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.44 HG13 ' H ' ' A' ' 4' ' ' ILE . 0.1 OUTLIER -129.83 172.8 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.1 0 CA-C-O 122.184 0.992 . . . . 0.0 108.759 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.438 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 21.7 tt0 -129.47 131.74 46.76 Favored 'General case' 0 C--N 1.349 0.568 0 N-CA-C 104.756 -2.312 . . . . 0.0 104.756 176.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -86.74 170.81 11.43 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 113.556 -1.656 . . . . 0.0 110.599 178.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . 0.538 ' HZ2' ' HB3' ' A' ' 2' ' ' GLU . 14.4 mtmm -156.53 97.62 2.16 Favored Pre-proline 0 N--CA 1.447 -0.611 0 CA-C-N 110.904 -2.862 . . . . 0.0 105.771 178.045 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo . . . . . 0 CA--C 1.55 1.276 0 O-C-N 123.565 1.298 . . . . 0.0 114.609 -179.297 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.401 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 47.2 t 31.56 91.57 0.05 OUTLIER Pre-proline 0 C--N 1.351 0.654 0 C-N-CA 127.485 2.314 . . . . 0.0 110.631 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo -65.9 157.05 61.21 Favored 'Trans proline' 0 CA--C 1.579 2.73 0 N-CA-C 116.01 1.504 . . . . 0.0 116.01 179.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 36.0 Cg_exo -58.7 161.07 15.79 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 123.594 2.863 . . . . 0.0 118.297 179.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -71.45 117.92 5.4 Favored 'Trans proline' 0 C--N 1.37 1.69 0 N-CA-C 105.498 -2.539 . . . . 0.0 105.498 174.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.4 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.1 t -65.56 147.34 98.73 Favored Pre-proline 0 CA--C 1.551 0.997 0 CA-C-N 113.685 -1.598 . . . . 0.0 109.135 -178.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . 0.4 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 2.8 Cg_exo -68.1 159.64 52.19 Favored 'Trans proline' 0 C--N 1.363 1.329 0 N-CA-C 116.805 1.81 . . . . 0.0 116.805 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' PRO . . . . . 0.474 ' HG2' HH21 ' B' ' 10' ' ' ARG . 10.0 Cg_endo -76.28 119.81 5.42 Favored 'Trans proline' 0 CA--C 1.553 1.443 0 N-CA-C 107.785 -1.659 . . . . 0.0 107.785 175.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.34 168.45 10.56 Favored 'General case' 0 C--N 1.362 1.118 0 C-N-CA 118.495 -1.282 . . . . 0.0 109.879 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 74.68 73.53 0.1 Allowed 'General case' 0 C--N 1.356 0.865 0 CA-C-N 113.139 -1.846 . . . . 0.0 107.95 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . 0.474 HH21 ' HG2' ' B' ' 7' ' ' PRO 0.339 0.0 OUTLIER -164.41 96.58 0.77 Allowed 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 112.529 -2.123 . . . . 0.0 110.419 178.097 . . . . . . . . 4 4 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.129 0 CA-C-N 114.764 -1.107 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.452 -0.337 0 CA-C-O 121.997 0.903 . . . . 0.0 109.27 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.5 157.18 18.22 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.515 -178.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -141.09 153.85 45.64 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 110.615 -2.993 . . . . 0.0 105.139 -179.095 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.557 ' H ' HG12 ' A' ' 53' ' ' ILE . 22.7 mt -146.67 112.75 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 N-CA-C 104.924 -2.251 . . . . 0.0 104.924 -174.32 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 0.41 ' HA ' ' HB ' ' A' ' 53' ' ' ILE . . . -68.21 144.2 55.02 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-N 112.033 -2.349 . . . . 0.0 110.715 -178.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 mtmt -98.95 -28.04 13.61 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 128.21 2.604 . . . . 0.0 113.205 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -144.63 164.21 31.63 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 117.521 -1.672 . . . . 0.0 108.463 -179.341 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -64.53 143.57 57.82 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 113.398 -1.728 . . . . 0.0 107.876 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -142.46 142.67 32.35 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 122.857 1.313 . . . . 0.0 107.902 177.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.25 115.55 16.47 Favored 'General case' 0 CA--C 1.56 1.332 0 CA-C-N 111.632 -2.531 . . . . 0.0 109.687 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.35 147.93 2.13 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.372 0.606 . . . . 0.0 112.435 -177.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.7 p -121.96 -5.52 9.03 Favored 'General case' 0 C--N 1.353 0.74 0 CA-C-N 113.449 -1.705 . . . . 0.0 112.602 -178.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.55 165.34 34.55 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-O 123.34 1.543 . . . . 0.0 110.287 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -50.67 -35.99 33.57 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 110.28 -3.145 . . . . 0.0 115.453 -178.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 52.4 p-10 -93.23 0.9 57.22 Favored 'General case' 0 C--N 1.352 0.684 0 O-C-N 124.444 1.09 . . . . 0.0 113.811 -176.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -109.81 160.81 16.03 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 114.152 -1.385 . . . . 0.0 109.71 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.8 161.09 36.56 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-N 113.754 -1.566 . . . . 0.0 110.109 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.0 m -84.87 163.74 18.83 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 113.676 -1.602 . . . . 0.0 115.186 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 50.9 p90 -164.41 160.46 20.7 Favored 'General case' 0 C--N 1.359 0.991 0 CA-C-N 110.85 -2.886 . . . . 0.0 109.788 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.36 119.36 16.42 Favored 'General case' 0 C--N 1.348 0.542 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.671 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -4.04 92.58 0.01 OUTLIER 'General case' 0 C--N 1.363 1.154 0 C-N-CA 127.185 2.194 . . . . 0.0 114.23 -178.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 118.29 8.03 10.68 Favored Glycine 0 C--N 1.353 1.485 0 O-C-N 125.014 1.446 . . . . 0.0 116.252 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 59.5 m-20 -62.28 152.95 32.15 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 117.372 -1.731 . . . . 0.0 112.936 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 83.6 mt -96.16 112.22 27.94 Favored 'Isoleucine or valine' 0 C--N 1.352 0.702 0 N-CA-C 104.895 -2.261 . . . . 0.0 104.895 178.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.93 145.79 29.62 Favored 'General case' 0 C--N 1.352 0.706 0 CA-C-N 113.302 -1.772 . . . . 0.0 111.037 -176.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.12 113.03 24.15 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-N 111.714 -2.494 . . . . 0.0 108.429 177.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 t -86.35 108.03 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 115.106 -2.638 . . . . 0.0 111.404 -174.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 12.4 tp -91.79 -4.2 55.22 Favored 'General case' 0 C--N 1.351 0.641 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 -178.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -174.63 137.25 0.46 Allowed 'General case' 0 C--N 1.348 0.536 0 C-N-CA 117.827 -1.549 . . . . 0.0 107.667 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -154.18 86.8 1.17 Allowed 'General case' 0 C--N 1.348 0.515 0 CA-C-N 113.714 -1.585 . . . . 0.0 108.541 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.58 ' CG ' ' H ' ' A' ' 32' ' ' CYS . 2.1 tp10 -74.23 -151.88 0.03 OUTLIER 'General case' 0 N--CA 1.421 -1.892 0 CA-C-N 112.903 -1.953 . . . . 0.0 106.663 178.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.58 ' H ' ' CG ' ' A' ' 31' ' ' GLU . 87.1 m -81.66 -9.42 59.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 112.656 -2.065 . . . . 0.0 112.144 -177.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.27 106.87 1.18 Allowed 'General case' 0 C--N 1.374 1.664 0 C-N-CA 117.339 -1.744 . . . . 0.0 109.694 -178.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -92.11 106.78 18.72 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 178.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 141.62 -13.64 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 O-C-N 126.853 2.596 . . . . 0.0 111.624 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.7 m95 -139.0 154.84 48.3 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-O 121.316 0.579 . . . . 0.0 110.373 -177.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -136.15 137.57 41.09 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 104.728 -2.323 . . . . 0.0 104.728 175.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -98.78 117.48 33.35 Favored 'General case' 0 C--N 1.353 0.723 0 N-CA-C 105.212 -2.144 . . . . 0.0 105.212 176.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.38 174.95 10.0 Favored 'General case' 0 C--N 1.352 0.68 0 O-C-N 124.346 1.029 . . . . 0.0 111.793 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.5 132.15 52.85 Favored 'General case' 0 C--N 1.359 1.018 0 O-C-N 124.482 1.114 . . . . 0.0 110.23 -178.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.257 9.8 mt -159.84 145.8 15.77 Favored 'General case' 0 C--N 1.36 1.025 0 CA-C-N 111.482 -2.599 . . . . 0.0 114.736 178.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.26 28.27 13.03 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 110.723 -2.944 . . . . 0.0 115.011 170.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.9 11.54 82.53 Favored Glycine 0 CA--C 1.541 1.688 0 C-N-CA 119.612 -1.28 . . . . 0.0 114.509 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -138.51 -177.89 5.05 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-O 122.566 1.174 . . . . 0.0 110.225 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -141.93 133.07 26.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 112.232 -2.258 . . . . 0.0 105.556 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -173.05 173.65 45.68 Favored Glycine 0 C--N 1.338 0.688 0 C-N-CA 117.437 -2.316 . . . . 0.0 111.834 -178.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -77.73 146.61 35.83 Favored 'General case' 0 CA--C 1.56 1.356 0 CA-C-N 112.54 -1.83 . . . . 0.0 110.665 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.9 pt -143.79 144.75 28.16 Favored Pre-proline 0 C--N 1.352 0.711 0 CA-C-N 111.414 -2.63 . . . . 0.0 107.475 177.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -80.18 138.61 12.81 Favored 'Trans proline' 0 C--N 1.367 1.534 0 N-CA-C 114.808 1.042 . . . . 0.0 114.808 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.52 -35.06 70.58 Favored 'General case' 0 C--N 1.354 0.768 0 CA-C-O 117.009 -1.472 . . . . 0.0 113.009 -178.44 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.277 0.5 OUTLIER -63.03 -10.71 15.06 Favored 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 113.046 -3.462 . . . . 0.0 112.834 178.146 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -94.67 -15.08 24.25 Favored 'General case' 0 CA--C 1.555 1.159 0 CA-C-O 117.47 -1.253 . . . . 0.0 108.942 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.557 HG12 ' H ' ' A' ' 4' ' ' ILE . 0.0 OUTLIER -133.98 160.56 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-O 122.901 1.334 . . . . 0.0 111.111 178.481 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 18.3 tt0 -126.9 145.01 50.83 Favored 'General case' 0 C--N 1.346 0.424 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 178.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 0.434 ' CE ' ' H ' ' A' ' 55' ' ' MET . 0.0 OUTLIER -86.13 162.31 18.45 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.261 -179.976 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.77 92.49 3.62 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-N 112.825 -1.989 . . . . 0.0 108.203 -179.414 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo . . . . . 0 C--N 1.363 1.293 0 C-N-CA 121.166 1.244 . . . . 0.0 111.768 179.054 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.225 -0.229 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 61.9 t -99.33 111.55 61.43 Favored Pre-proline 0 C--N 1.348 0.54 0 O-C-N 125.457 1.723 . . . . 0.0 107.621 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -71.24 164.17 36.66 Favored 'Trans proline' 0 CA--C 1.571 2.331 0 N-CA-C 116.494 1.69 . . . . 0.0 116.494 176.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -50.6 160.18 1.83 Allowed 'Trans proline' 0 C--N 1.372 1.816 0 C-N-CA 124.499 3.466 . . . . 0.0 118.74 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -75.69 112.77 3.59 Favored 'Trans proline' 0 C--N 1.357 1.02 0 N-CA-C 106.621 -2.107 . . . . 0.0 106.621 176.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 3.5 t -58.26 143.61 79.08 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 113.256 -1.793 . . . . 0.0 109.824 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -61.2 150.31 85.16 Favored 'Trans proline' 0 C--N 1.359 1.117 0 O-C-N 122.789 0.889 . . . . 0.0 114.067 179.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_endo -67.68 111.78 2.46 Favored 'Trans proline' 0 C--N 1.364 1.391 0 N-CA-C 107.713 -1.687 . . . . 0.0 107.713 177.064 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.63 96.92 7.01 Favored 'General case' 0 C--N 1.353 0.761 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 -178.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 6.0 mtp85 -160.88 62.13 0.3 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 112.178 -2.283 . . . . 0.0 111.466 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 174.28 132.74 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 113.43 -1.713 . . . . 0.0 106.384 178.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 0.413 0 CA-C-N 114.489 -1.232 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.465 0.279 0 CA-C-O 121.81 0.814 . . . . 0.0 109.488 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -105.86 143.85 33.41 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 112.719 -2.037 . . . . 0.0 105.633 -177.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -133.77 156.53 47.82 Favored 'General case' 0 C--N 1.351 0.656 0 CA-C-N 112.33 -2.214 . . . . 0.0 109.132 -177.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.1 mt -145.01 117.42 2.34 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 CA-C-N 112.647 -2.07 . . . . 0.0 109.762 -176.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.43 125.22 26.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 117.296 -1.762 . . . . 0.0 108.311 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.9 -24.95 16.18 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.521 -1.218 . . . . 0.0 114.139 -178.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -142.49 165.65 26.83 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 -179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -68.84 157.97 35.42 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 116.69 -2.004 . . . . 0.0 109.173 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -145.96 142.78 29.02 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 118.554 -1.258 . . . . 0.0 108.895 175.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -129.44 100.96 5.75 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 127.333 2.253 . . . . 0.0 108.993 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.844 ' H ' ' HG ' ' A' ' 18' ' ' SER . . . -44.93 160.26 0.04 OUTLIER 'General case' 0 C--N 1.352 0.696 0 CA-C-O 123.079 1.419 . . . . 0.0 113.862 -177.16 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 p -117.12 -25.63 7.08 Favored 'General case' 0 CA--C 1.557 1.247 0 CA-C-N 110.648 -2.978 . . . . 0.0 112.348 -178.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.73 168.15 26.63 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 117.096 -1.842 . . . . 0.0 110.628 -177.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -42.54 -40.58 2.7 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 109.949 -3.296 . . . . 0.0 114.352 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -85.83 0.86 51.87 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -177.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -112.13 155.84 23.26 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 178.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.4 pp -136.63 155.58 49.71 Favored 'General case' 0 C--N 1.345 0.411 0 CA-C-N 113.371 -1.74 . . . . 0.0 108.422 178.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' SER . . . . . 0.844 ' HG ' ' H ' ' A' ' 11' ' ' ALA . 22.0 m -87.15 173.17 9.41 Favored 'General case' 0 CA--C 1.47 -2.125 0 N-CA-C 119.274 3.065 . . . . 0.0 119.274 -177.553 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -162.88 -175.6 4.48 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 108.532 -3.94 . . . . 0.0 108.625 175.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.73 140.58 34.88 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 112.328 -2.214 . . . . 0.0 105.95 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.81 101.57 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.875 0 O-C-N 124.974 1.421 . . . . 0.0 111.63 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 136.3 -25.04 3.19 Favored Glycine 0 C--N 1.355 1.59 0 CA-C-N 113.96 -1.473 . . . . 0.0 114.232 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -58.38 145.86 36.81 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 117.036 -1.865 . . . . 0.0 112.8 -177.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.2 mm -97.58 113.95 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 103.398 -2.815 . . . . 0.0 103.398 178.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -100.96 162.78 12.65 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 116.241 -2.184 . . . . 0.0 109.697 -175.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -103.31 111.07 23.31 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 108.949 -3.751 . . . . 0.0 105.903 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 90.1 t -87.83 100.34 10.07 Favored 'Isoleucine or valine' 0 C--N 1.342 0.275 0 C-N-CA 116.391 -2.124 . . . . 0.0 111.259 -175.018 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -95.5 90.1 5.64 Favored 'General case' 0 C--N 1.349 0.579 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 177.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 57.66 -177.46 0.06 Allowed 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 113.306 -1.77 . . . . 0.0 112.737 178.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -158.26 115.07 2.84 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 110.643 -2.981 . . . . 0.0 106.365 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.42 ' O ' ' CB ' ' A' ' 32' ' ' CYS . 6.0 pt-20 -171.5 116.92 0.42 Allowed 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 118.203 -1.399 . . . . 0.0 108.302 -178.126 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 31' ' ' GLU . 2.0 t 149.76 -51.85 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 113.486 -1.688 . . . . 0.0 110.786 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -159.11 116.97 2.81 Favored 'General case' 0 C--N 1.359 0.987 0 C-N-CA 117.47 -1.692 . . . . 0.0 111.932 179.284 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -61.74 107.63 0.86 Allowed 'General case' 0 C--N 1.351 0.638 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 179.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.6 m-20 145.1 -11.2 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.074 0 O-C-N 128.046 3.341 . . . . 0.0 113.004 -174.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -136.39 161.01 37.02 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.997 0.903 . . . . 0.0 109.517 -177.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -131.91 145.1 51.31 Favored 'General case' 0 C--N 1.345 0.381 0 CA-C-N 112.926 -1.943 . . . . 0.0 106.4 178.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 38.8 tttm -101.65 121.27 41.71 Favored 'General case' 0 C--N 1.348 0.523 0 N-CA-C 105.852 -1.906 . . . . 0.0 105.852 177.285 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -142.29 176.4 9.02 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 118.719 -1.192 . . . . 0.0 113.464 -176.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -120.73 140.18 52.02 Favored 'General case' 0 C--O 1.203 -1.362 0 CA-C-O 123.608 1.67 . . . . 0.0 111.879 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.29 16.1 mt -162.14 154.66 19.65 Favored 'General case' 0 C--O 1.189 -2.109 0 CA-C-N 110.033 -3.258 . . . . 0.0 114.005 178.055 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 48.69 23.4 0.64 Allowed 'General case' 0 CA--C 1.555 1.163 0 O-C-N 127.163 2.79 . . . . 0.0 116.237 169.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.94 -5.43 85.13 Favored Glycine 0 CA--C 1.559 2.825 0 N-CA-C 116.439 1.336 . . . . 0.0 116.439 -178.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.9 mtmt -118.57 173.43 6.85 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 123.163 1.459 . . . . 0.0 107.811 177.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.0 p-10 -142.6 133.31 25.37 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 111.7 -2.5 . . . . 0.0 106.8 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -169.36 178.03 42.69 Favored Glycine 0 C--N 1.346 1.124 0 C-N-CA 117.091 -2.48 . . . . 0.0 111.344 -178.434 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -77.46 146.96 36.16 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 118.62 -1.232 . . . . 0.0 112.684 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 21.1 pt -142.29 137.74 15.93 Favored Pre-proline 0 C--N 1.359 0.999 0 CA-C-N 112.62 -2.082 . . . . 0.0 107.506 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -70.38 147.89 59.88 Favored 'Trans proline' 0 C--N 1.356 0.955 0 N-CA-C 114.339 0.861 . . . . 0.0 114.339 -176.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -71.11 -43.29 67.94 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 116.597 -2.041 . . . . 0.0 111.371 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.0 p-10 -53.91 -23.99 14.63 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 178.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -89.54 -3.23 58.42 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 118.986 -1.086 . . . . 0.0 111.518 -179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.413 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -129.54 173.61 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.142 0 CA-C-N 119.64 1.109 . . . . 0.0 108.909 178.775 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.413 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 31.3 tt0 -129.81 121.03 25.98 Favored 'General case' 0 C--N 1.347 0.49 0 N-CA-C 103.487 -2.783 . . . . 0.0 103.487 178.148 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -87.36 160.63 18.3 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-N 113.143 -1.844 . . . . 0.0 112.143 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -154.61 80.92 4.49 Favored Pre-proline 0 CA--C 1.55 0.946 0 CA-C-N 112.595 -2.093 . . . . 0.0 109.533 177.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo . . . . . 0 C--N 1.367 1.54 0 C-N-CA 121.074 1.183 . . . . 0.0 110.584 179.231 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.376 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 5.3 p -97.56 119.66 62.24 Favored Pre-proline 0 CA--C 1.539 0.531 0 O-C-N 124.917 1.386 . . . . 0.0 108.322 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . 0.258 3.4 Cg_exo -70.22 151.71 66.55 Favored 'Trans proline' 0 N--CA 1.431 -2.195 0 N-CA-C 115.186 1.187 . . . . 0.0 115.186 176.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -45.91 155.52 0.56 Allowed 'Trans proline' 0 C--N 1.368 1.586 0 C-N-CA 123.127 2.551 . . . . 0.0 116.518 -179.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -76.0 105.82 2.15 Favored 'Trans proline' 0 C--N 1.366 1.484 0 N-CA-C 106.256 -2.248 . . . . 0.0 106.256 178.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 4.2 t -50.36 146.13 9.37 Favored Pre-proline 0 CA--C 1.559 1.314 0 CA-C-N 113.492 -1.686 . . . . 0.0 110.639 -178.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.69 155.66 69.4 Favored 'Trans proline' 0 C--N 1.365 1.44 0 C-N-CA 120.937 1.091 . . . . 0.0 113.854 178.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -73.37 110.29 3.03 Favored 'Trans proline' 0 C--N 1.356 0.928 0 N-CA-C 106.164 -2.283 . . . . 0.0 106.164 176.492 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.17 94.67 4.12 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 116.747 -1.981 . . . . 0.0 106.247 -179.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 4.9 ttm180 -141.63 -77.48 0.28 Allowed 'General case' 0 N--CA 1.425 -1.716 0 CA-C-N 111.062 -2.79 . . . . 0.0 109.187 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -174.46 90.81 0.07 Allowed 'General case' 0 N--CA 1.434 -1.233 1 CA-C-N 108.307 -4.042 . . . . 0.0 109.385 -179.871 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.268 0 CA-C-N 114.071 -1.422 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.397 0 CA-C-O 121.445 0.641 . . . . 0.0 110.904 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -100.66 152.81 20.0 Favored 'General case' 0 C--N 1.363 1.175 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 176.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -136.65 152.69 50.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 111.903 -2.408 . . . . 0.0 108.497 -178.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.2 mt -150.19 122.6 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.352 0.706 0 CA-C-N 113.239 -1.8 . . . . 0.0 109.784 -175.809 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.04 127.57 33.07 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 113.31 -1.768 . . . . 0.0 110.788 178.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.12 -24.14 18.37 Favored 'General case' 0 CA--C 1.558 1.274 0 CA-C-N 113.887 -1.506 . . . . 0.0 112.577 178.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -141.34 166.5 24.6 Favored 'General case' 0 C--N 1.355 0.836 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.019 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -68.86 156.21 38.84 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 116.689 -2.004 . . . . 0.0 108.176 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -146.24 138.82 25.39 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 174.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.407 ' O ' ' CD ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -129.39 103.24 6.8 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 106.506 -1.664 . . . . 0.0 106.506 177.266 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.96 157.62 0.15 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 122.954 1.359 . . . . 0.0 112.236 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -148.29 20.82 1.08 Allowed 'General case' 0 CA--C 1.565 1.548 0 CA-C-N 111.073 -2.785 . . . . 0.0 114.19 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.84 140.7 20.11 Favored 'General case' 0 C--N 1.348 0.527 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -43.08 -32.85 0.75 Allowed 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 114.131 -1.395 . . . . 0.0 114.048 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 53.8 p30 -92.54 -4.59 53.26 Favored 'General case' 0 CA--C 1.568 1.663 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 -178.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -107.34 154.74 20.84 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.89 0.852 . . . . 0.0 108.849 -178.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 pp -133.3 158.72 42.24 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 112.481 -2.145 . . . . 0.0 111.161 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.7 m -85.75 171.63 11.45 Favored 'General case' 0 C--N 1.35 0.601 0 N-CA-C 117.191 2.293 . . . . 0.0 117.191 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.4 p90 -164.36 166.53 20.67 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 109.827 -3.352 . . . . 0.0 109.115 174.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -134.96 111.72 10.05 Favored 'General case' 0 CA--C 1.557 1.236 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.367 178.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -3.88 93.23 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 127.516 2.326 . . . . 0.0 113.962 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 120.38 3.7 11.4 Favored Glycine 0 CA--C 1.547 2.034 0 CA-C-N 113.688 -1.596 . . . . 0.0 116.495 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -59.12 155.45 13.89 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-O 122.58 1.181 . . . . 0.0 113.196 -178.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 pt -96.93 103.92 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.319 0 CA-C-N 111.16 -2.745 . . . . 0.0 104.851 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -108.05 158.95 16.95 Favored 'General case' 0 C--N 1.349 0.587 0 CA-C-N 113.804 -1.543 . . . . 0.0 110.812 -176.181 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.73 109.64 14.49 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 112.295 -2.23 . . . . 0.0 107.192 177.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 1.8 m -85.88 114.98 26.49 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 C-N-CA 117.099 -1.84 . . . . 0.0 110.24 -176.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -88.81 -8.47 54.3 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 111.828 -2.442 . . . . 0.0 117.015 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -177.0 164.32 2.27 Favored 'General case' 0 C--N 1.351 0.662 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.141 -178.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -168.62 77.14 0.12 Allowed 'General case' 0 C--N 1.348 0.527 0 C-N-CA 115.456 -2.498 . . . . 0.0 111.744 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 174.93 48.31 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 111.872 -2.422 . . . . 0.0 110.241 -179.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 44.6 m -100.5 -54.45 2.84 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-N 114.52 -1.218 . . . . 0.0 112.379 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -165.35 74.39 0.22 Allowed 'General case' 0 C--N 1.348 0.538 0 O-C-N 125.748 1.905 . . . . 0.0 107.793 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -17.61 90.82 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 128.384 2.673 . . . . 0.0 112.581 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.2 m120 146.62 -1.61 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 131.583 3.953 . . . . 0.0 114.87 -171.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -139.96 168.47 19.73 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 121.535 0.684 . . . . 0.0 109.406 -176.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -140.87 150.1 42.8 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.396 -1.274 . . . . 0.0 107.841 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -103.99 117.95 35.51 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 105.397 -2.075 . . . . 0.0 105.397 176.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -140.5 176.62 8.63 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 123.982 0.801 . . . . 0.0 112.399 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -112.03 135.75 52.28 Favored 'General case' 0 C--N 1.364 1.21 0 O-C-N 123.89 0.743 . . . . 0.0 109.728 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 18.5 mt -160.36 143.67 13.64 Favored 'General case' 0 CA--C 1.468 -2.181 0 C-N-CA 126.864 2.066 . . . . 0.0 115.685 -178.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.25 32.31 18.33 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 115.358 -2.537 . . . . 0.0 115.967 168.437 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.1 -4.92 68.61 Favored Glycine 0 CA--C 1.558 2.774 0 C-N-CA 119.891 -1.147 . . . . 0.0 115.696 -178.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.0 -175.68 3.29 Favored 'General case' 0 C--N 1.352 0.705 0 CA-C-O 122.983 1.373 . . . . 0.0 109.505 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -142.48 134.25 26.9 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 111.61 -2.541 . . . . 0.0 104.789 178.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.45 175.5 45.59 Favored Glycine 0 C--N 1.35 1.317 0 C-N-CA 116.373 -2.822 . . . . 0.0 112.215 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -77.49 143.67 38.31 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 117.927 -1.509 . . . . 0.0 112.014 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 pt -142.57 144.59 30.98 Favored Pre-proline 0 C--N 1.356 0.865 0 CA-C-N 112.064 -2.335 . . . . 0.0 107.817 179.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -77.79 155.38 30.79 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 N-CA-C 118.471 2.451 . . . . 0.0 118.471 -177.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.7 mttt -68.61 -56.5 8.03 Favored 'General case' 0 C--N 1.36 1.042 0 CA-C-N 112.651 -2.068 . . . . 0.0 110.261 178.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.321 0.7 OUTLIER -59.19 -8.34 1.55 Allowed 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 115.28 -2.568 . . . . 0.0 115.683 -179.752 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -95.07 -11.54 28.13 Favored 'General case' 0 CA--C 1.567 1.622 0 CA-C-O 117.642 -1.17 . . . . 0.0 113.55 175.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.404 ' CG1' ' N ' ' A' ' 54' ' ' GLU . 0.1 OUTLIER -133.15 166.56 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 CA-C-N 120.368 1.44 . . . . 0.0 110.159 -178.915 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.404 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 8.3 tt0 -127.71 136.02 50.97 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 112.543 -2.117 . . . . 0.0 105.583 175.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 5.5 mtp -85.24 167.83 15.3 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 114.04 -1.436 . . . . 0.0 108.885 179.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.1 mtpt -155.0 93.18 2.77 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 117.464 -1.694 . . . . 0.0 111.519 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo . . . . . 0 C--N 1.364 1.379 0 C-N-CA 121.687 1.592 . . . . 0.0 108.556 173.746 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.357 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 53.3 t -56.52 106.84 0.73 Allowed Pre-proline 0 CA--C 1.548 0.885 0 O-C-N 124.747 1.279 . . . . 0.0 109.033 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -70.41 156.38 61.76 Favored 'Trans proline' 0 N--CA 1.443 -1.47 0 N-CA-C 117.063 1.909 . . . . 0.0 117.063 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -50.58 159.13 2.33 Favored 'Trans proline' 0 C--N 1.369 1.614 0 C-N-CA 122.07 1.847 . . . . 0.0 115.141 177.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -71.07 119.47 6.33 Favored 'Trans proline' 0 C--N 1.363 1.328 0 N-CA-C 104.394 -2.964 . . . . 0.0 104.394 176.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 5.4 t -62.85 148.85 91.12 Favored Pre-proline 0 CA--C 1.545 0.771 0 O-C-N 124.59 1.181 . . . . 0.0 108.39 -178.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -67.43 163.62 33.98 Favored 'Trans proline' 0 N--CA 1.443 -1.465 0 N-CA-C 115.778 1.415 . . . . 0.0 115.778 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -71.62 119.42 6.22 Favored 'Trans proline' 0 C--N 1.364 1.372 0 O-C-N 124.633 1.86 . . . . 0.0 108.589 175.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.42 67.85 2.94 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-O 123.349 1.547 . . . . 0.0 109.167 178.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 165.1 84.56 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 110.447 -3.069 . . . . 0.0 106.104 -179.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -9.6 -63.68 0.0 OUTLIER 'General case' 0 C--N 1.352 0.678 0 CA-C-N 111.139 -2.755 . . . . 0.0 113.585 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.085 0 CA-C-N 110.304 -3.134 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.482 ' CG ' ' H ' ' A' ' 2' ' ' GLU . 2.9 ttp . . . . . 0 N--CA 1.437 -1.118 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.482 ' H ' ' CG ' ' A' ' 1' ' ' MET . 15.3 pt-20 -6.64 -172.69 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.513 1 C-N-CA 133.929 4.892 . . . . 0.0 119.408 173.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.48 ' CB ' ' CD1' ' A' ' 53' ' ' ILE . . . 87.93 133.96 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.104 2 C-N-CA 138.153 6.581 . . . . 0.0 109.764 178.696 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 11.4 mm -148.11 123.19 2.25 Favored 'Isoleucine or valine' 0 C--N 1.354 0.793 0 CA-C-N 109.04 -3.709 . . . . 0.0 106.391 -178.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.71 125.87 27.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.919 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -96.55 -22.89 16.8 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 113.119 -1.855 . . . . 0.0 114.215 -179.023 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -142.22 168.87 18.72 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 124.807 1.317 . . . . 0.0 107.75 -179.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -68.0 146.63 53.37 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 118.17 -1.412 . . . . 0.0 107.832 177.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -145.69 128.78 16.59 Favored 'General case' 0 C--N 1.355 0.841 0 C-N-CA 117.385 -1.726 . . . . 0.0 108.967 176.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.21 102.09 9.28 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-N 111.007 -2.815 . . . . 0.0 109.045 -178.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.05 170.02 0.01 OUTLIER 'General case' 0 C--N 1.382 1.996 0 CA-C-O 124.418 2.056 . . . . 0.0 113.28 -179.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.306 44.2 p -123.92 -25.15 4.29 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 109.886 -3.324 . . . . 0.0 111.175 -177.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.05 172.75 16.39 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 117.81 -1.556 . . . . 0.0 112.259 -174.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -59.84 -25.47 65.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 110.99 -2.823 . . . . 0.0 113.931 -177.034 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -87.32 -7.66 57.55 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 118.952 -1.099 . . . . 0.0 111.082 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -111.24 162.82 14.58 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 114.043 -1.435 . . . . 0.0 107.495 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -138.08 156.84 47.37 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 113.827 -1.533 . . . . 0.0 109.029 178.316 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 3.1 m -86.59 162.9 17.75 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 123.425 1.583 . . . . 0.0 115.191 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -162.74 167.77 22.51 Favored 'General case' 0 C--N 1.356 0.854 0 CA-C-N 109.307 -3.588 . . . . 0.0 107.871 175.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.52 147.11 52.17 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 111.005 -2.816 . . . . 0.0 104.71 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -43.04 99.49 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.707 0 O-C-N 125.835 1.96 . . . . 0.0 113.089 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.89 -34.41 1.86 Allowed Glycine 0 C--N 1.351 1.389 0 CA-C-N 113.623 -1.626 . . . . 0.0 115.527 177.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -45.85 151.82 0.42 Allowed 'General case' 0 C--N 1.359 1.016 0 N-CA-C 115.687 1.736 . . . . 0.0 115.687 -177.169 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.9 mt -100.62 121.66 51.67 Favored 'Isoleucine or valine' 0 C--N 1.35 0.622 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 176.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.447 ' CD2' ' CD1' ' A' ' 48' ' ' ILE . 0.0 OUTLIER -106.86 140.96 38.86 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 -179.003 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.02 110.91 23.0 Favored 'General case' 0 C--O 1.209 -1.069 2 CA-C-N 107.181 -4.554 . . . . 0.0 107.622 -179.173 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 3.5 m -88.05 115.58 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 C-N-CA 118.703 -1.199 . . . . 0.0 110.7 -176.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.74 -9.92 27.91 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-N 113.017 -1.901 . . . . 0.0 110.831 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 179.5 150.92 0.35 Allowed 'General case' 0 C--N 1.356 0.857 0 CA-C-N 115.426 -0.806 . . . . 0.0 108.982 -178.188 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -171.03 100.08 0.21 Allowed 'General case' 0 C--N 1.365 1.265 0 C-N-CA 117.173 -1.811 . . . . 0.0 111.746 -178.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 170.76 31.16 0.0 OUTLIER 'General case' 0 C--N 1.354 0.769 0 O-C-N 125.914 2.008 . . . . 0.0 112.64 -179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 15.3 p -74.09 -56.15 5.26 Favored 'General case' 0 C--N 1.349 0.573 0 CA-C-N 114.12 -1.4 . . . . 0.0 108.892 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -160.85 48.83 0.23 Allowed 'General case' 0 CA--C 1.558 1.266 0 O-C-N 124.922 1.389 . . . . 0.0 113.53 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 16.34 80.19 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 128.637 2.775 . . . . 0.0 113.578 177.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 172.46 -12.65 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.354 0 C-N-CA 130.112 3.365 . . . . 0.0 110.763 -177.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 69.4 m95 -129.65 174.3 9.82 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-O 121.8 0.809 . . . . 0.0 110.25 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -142.83 138.14 30.12 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 126.058 1.743 . . . . 0.0 107.145 174.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.6 tttm -100.2 114.87 28.61 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 175.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -136.08 172.69 12.65 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 118.671 -1.212 . . . . 0.0 111.578 -175.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -112.6 145.46 40.33 Favored 'General case' 0 C--N 1.367 1.355 0 O-C-N 125.481 1.738 . . . . 0.0 110.53 -177.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . 0.295 4.4 mt -159.22 135.6 9.14 Favored 'General case' 0 C--N 1.361 1.104 0 CA-C-N 109.086 -3.688 . . . . 0.0 112.794 178.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.87 28.43 10.43 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 112.431 -2.168 . . . . 0.0 114.971 170.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 72.37 29.14 66.59 Favored Glycine 0 CA--C 1.55 2.244 0 C-N-CA 119.775 -1.202 . . . . 0.0 114.067 -179.186 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -139.31 157.82 45.23 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 126.782 2.033 . . . . 0.0 107.711 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -139.73 142.28 36.83 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -176.95 173.62 46.44 Favored Glycine 0 CA--C 1.53 1.024 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.874 -179.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -77.18 145.36 37.71 Favored 'General case' 0 CA--C 1.573 1.827 0 CA-C-O 122.834 1.302 . . . . 0.0 111.542 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.447 ' CD1' ' CD2' ' A' ' 25' ' ' LEU . 47.2 pt -143.73 143.89 25.11 Favored Pre-proline 0 C--N 1.355 0.827 0 CA-C-N 113.6 -1.636 . . . . 0.0 107.685 178.025 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -73.06 144.91 38.66 Favored 'Trans proline' 0 C--N 1.346 0.447 0 N-CA-C 114.318 0.853 . . . . 0.0 114.318 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.04 -40.79 71.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 115.071 -2.652 . . . . 0.0 111.985 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 10.5 p-10 -55.43 -19.39 9.15 Favored 'General case' 0 CA--C 1.562 1.411 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 177.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -93.25 -4.39 51.96 Favored 'General case' 0 C--N 1.366 1.309 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.48 ' CD1' ' CB ' ' A' ' 3' ' ' ALA . 0.4 OUTLIER -129.25 176.92 7.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.665 0 CA-C-O 122.991 1.377 . . . . 0.0 111.216 -179.412 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -132.32 138.53 47.83 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 110.807 -2.906 . . . . 0.0 104.942 177.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.34 141.8 28.22 Favored 'General case' 0 C--N 1.35 0.611 0 O-C-N 124.25 0.969 . . . . 0.0 111.691 176.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -97.07 92.42 1.17 Allowed Pre-proline 0 CA--C 1.583 2.222 0 O-C-N 124.196 0.935 . . . . 0.0 110.96 171.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo . . . . . 0 C--N 1.381 2.281 0 C-N-CA 122.946 2.43 . . . . 0.0 111.381 176.883 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.225 -0.233 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 7.4 p 23.09 117.91 0.0 OUTLIER Pre-proline 0 C--N 1.352 0.714 0 C-N-CA 128.276 2.63 . . . . 0.0 112.415 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -73.03 153.48 52.29 Favored 'Trans proline' 0 N--CA 1.44 -1.645 0 C-N-CA 117.541 -1.173 . . . . 0.0 114.378 176.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -51.79 162.09 1.89 Allowed 'Trans proline' 0 C--N 1.367 1.51 0 C-N-CA 122.602 2.201 . . . . 0.0 115.577 177.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -82.96 109.28 1.69 Allowed 'Trans proline' 0 CA--C 1.539 0.75 0 N-CA-C 105.931 -2.373 . . . . 0.0 105.931 175.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.412 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 2.5 t -49.1 148.05 4.48 Favored Pre-proline 0 CA--C 1.56 1.353 0 CA-C-N 113.563 -1.653 . . . . 0.0 111.802 -177.637 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' PRO . . . . . 0.412 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 26.8 Cg_exo -67.3 153.98 75.46 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 123.06 2.506 . . . . 0.0 115.689 178.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -65.85 114.35 2.92 Favored 'Trans proline' 0 C--N 1.372 1.794 0 N-CA-C 107.106 -1.921 . . . . 0.0 107.106 175.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -95.25 93.42 7.28 Favored 'General case' 0 C--O 1.22 -0.482 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 151.95 79.05 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 O-C-N 125.776 1.923 . . . . 0.0 108.719 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.27 73.72 3.85 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 111.52 -2.582 . . . . 0.0 110.987 178.47 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.006 0 CA-C-N 115.198 -0.91 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.744 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . . . . . . . . 0 N--CA 1.444 -0.733 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.411 ' H ' HG13 ' A' ' 53' ' ' ILE . 47.4 mm -143.7 116.37 3.03 Favored 'Isoleucine or valine' 0 C--N 1.349 0.574 0 CA-C-N 112.484 -2.143 . . . . 0.0 109.623 -175.175 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.424 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -68.27 125.89 27.84 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.185 177.269 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.1 mmmt -97.35 -26.0 15.03 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.002 -0.999 . . . . 0.0 113.055 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -142.08 168.28 20.11 Favored 'General case' 0 C--N 1.351 0.645 0 O-C-N 125.031 1.457 . . . . 0.0 107.847 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -68.98 145.43 53.6 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 113.591 -1.64 . . . . 0.0 109.129 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -146.95 128.92 15.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 116.946 -1.902 . . . . 0.0 111.166 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.2 mmtp -120.49 112.94 19.59 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 112.346 -2.207 . . . . 0.0 108.028 179.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.84 158.88 0.19 Allowed 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 123.408 1.575 . . . . 0.0 113.938 -177.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.1 p -114.28 -22.47 9.91 Favored 'General case' 0 C--N 1.346 0.417 0 CA-C-N 110.719 -2.946 . . . . 0.0 112.258 -177.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -154.03 173.05 16.53 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 113.354 -1.748 . . . . 0.0 111.238 -177.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -54.96 -31.27 60.49 Favored 'General case' 0 CA--C 1.553 1.078 0 CA-C-N 110.278 -3.147 . . . . 0.0 114.478 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 55.0 p-10 -88.88 -2.7 58.72 Favored 'General case' 0 C--N 1.353 0.739 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -178.029 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -112.94 156.6 22.73 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.011 -1.45 . . . . 0.0 108.552 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.42 HD23 ' C ' ' A' ' 45' ' ' ASP . 2.8 pp -135.04 152.38 51.64 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 111.994 -2.366 . . . . 0.0 108.64 177.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . 0.281 57.7 m -82.23 170.88 14.91 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 112.013 -2.358 . . . . 0.0 112.462 -177.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -163.81 -176.58 4.67 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 108.709 -3.86 . . . . 0.0 106.501 172.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.27 144.54 36.51 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.87 102.16 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.247 0 O-C-N 125.068 1.48 . . . . 0.0 112.514 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.424 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 136.25 -24.03 3.27 Favored Glycine 0 C--N 1.355 1.635 0 CA-C-N 115.016 -0.993 . . . . 0.0 114.584 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.402 ' HB3' HD21 ' A' ' 41' ' ' LEU . 4.1 m-20 -50.49 142.48 10.55 Favored 'General case' 0 C--N 1.359 1.01 0 CA-C-O 122.8 1.286 . . . . 0.0 114.2 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.7 mm -99.0 116.67 42.65 Favored 'Isoleucine or valine' 0 C--N 1.348 0.533 0 N-CA-C 102.156 -3.276 . . . . 0.0 102.156 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.744 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 3.1 mp -107.2 155.04 20.35 Favored 'General case' 0 C--N 1.349 0.545 0 O-C-N 124.606 1.191 . . . . 0.0 111.547 -176.508 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.63 110.92 23.01 Favored 'General case' 0 C--N 1.355 0.807 0 CA-C-N 111.343 -2.662 . . . . 0.0 108.854 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.603 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 58.9 t -87.42 106.96 16.67 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 C-N-CA 116.915 -1.914 . . . . 0.0 110.016 -176.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.7 tp . . . . . 0 CA--C 1.546 0.794 0 CA-C-N 112.148 -2.296 . . . . 0.0 107.516 179.212 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 49.5 m-20 . . . . . 0 CA--C 1.552 1.039 0 CA-C-O 118.269 -0.872 . . . . 0.0 113.212 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -140.26 166.41 24.75 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.776 0.798 . . . . 0.0 112.346 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -142.22 146.17 34.89 Favored 'General case' 0 C--N 1.357 0.923 0 CA-C-N 113.228 -1.806 . . . . 0.0 109.648 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.9 tttt -101.54 118.99 38.08 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 175.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.27 172.11 13.13 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 119.101 -1.04 . . . . 0.0 111.841 -177.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -109.77 136.23 49.42 Favored 'General case' 0 C--N 1.36 1.036 0 CA-C-N 114.128 -1.396 . . . . 0.0 111.227 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.402 HD21 ' HB3' ' A' ' 23' ' ' ASP 0.283 11.2 mt -160.13 136.02 8.49 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-N 111.755 -2.475 . . . . 0.0 114.611 179.477 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 57.3 21.49 6.77 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 110.731 -2.94 . . . . 0.0 116.32 170.517 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 94.74 10.7 57.56 Favored Glycine 0 CA--C 1.538 1.489 0 O-C-N 124.299 0.999 . . . . 0.0 113.557 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -132.01 169.42 16.36 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-O 122.137 0.97 . . . . 0.0 108.939 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.42 ' C ' HD23 ' A' ' 17' ' ' LEU . 8.7 p-10 -141.51 129.82 22.34 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 112.37 -2.196 . . . . 0.0 107.51 179.253 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.07 -179.96 43.32 Favored Glycine 0 C--N 1.348 1.244 0 C-N-CA 118.768 -1.682 . . . . 0.0 111.842 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -77.52 146.34 36.42 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 113.121 -1.539 . . . . 0.0 110.825 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.741 HD13 HD22 ' A' ' 25' ' ' LEU . 2.6 pt -142.83 144.26 28.86 Favored Pre-proline 0 CA--C 1.542 0.666 0 CA-C-N 111.125 -2.761 . . . . 0.0 106.843 179.186 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -79.2 145.79 19.45 Favored 'Trans proline' 0 C--N 1.364 1.377 0 N-CA-C 115.417 1.276 . . . . 0.0 115.417 -178.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -67.37 -44.24 79.43 Favored 'General case' 0 C--N 1.358 0.958 0 CA-C-N 113.996 -1.456 . . . . 0.0 111.568 -177.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.292 0.7 OUTLIER -67.36 -10.21 48.88 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 116.794 -1.962 . . . . 0.0 114.255 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -93.62 -10.2 35.44 Favored 'General case' 0 C--N 1.359 1.003 0 CA-C-O 118.417 -0.802 . . . . 0.0 111.474 176.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.677 ' CD1' ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -131.07 175.12 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-O 122.93 1.347 . . . . 0.0 110.088 179.864 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.516 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 33.3 tt0 -135.67 133.79 38.52 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 111.931 -2.395 . . . . 0.0 106.666 176.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 5.5 mtm . . . . . 0 C--N 1.348 0.522 0 CA-C-N 114.55 -1.205 . . . . 0.0 109.481 178.635 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo . . . . . 0 N--CA 1.446 -1.27 0 N-CA-C 115.069 1.142 . . . . 0.0 115.069 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -55.84 159.67 11.31 Favored 'Trans proline' 0 C--N 1.365 1.439 0 C-N-CA 122.453 2.102 . . . . 0.0 116.813 177.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -72.13 127.29 12.61 Favored 'Trans proline' 0 C--N 1.365 1.4 0 N-CA-C 105.822 -2.415 . . . . 0.0 105.822 173.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.452 HG12 ' HD2' ' B' ' 6' ' ' PRO . 3.0 t -71.33 149.55 94.02 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 118.107 -1.437 . . . . 0.0 109.438 -177.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 6' ' ' PRO . . . . . 0.452 ' HD2' HG12 ' B' ' 5' ' ' VAL . 15.7 Cg_exo -71.09 155.25 61.77 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 O-C-N 123.539 1.284 . . . . 0.0 114.797 178.204 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -70.54 123.42 9.83 Favored 'Trans proline' 0 CA--C 1.548 1.186 0 N-CA-C 106.306 -2.228 . . . . 0.0 106.306 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.352 0.705 0 C-N-CA 118.639 -1.224 . . . . 0.0 109.046 -179.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.703 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.449 -0.507 0 CA-C-O 122.17 0.986 . . . . 0.0 109.392 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.1 mt -147.0 116.17 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.646 0 CA-C-N 111.422 -2.626 . . . . 0.0 109.526 -178.177 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.27 129.51 40.13 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.747 177.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.0 mmmt -96.46 -23.67 16.47 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 113.797 -1.547 . . . . 0.0 113.291 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -141.92 168.81 18.88 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 125.203 1.564 . . . . 0.0 108.046 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -68.82 146.89 52.48 Favored 'General case' 0 C--N 1.357 0.892 0 CA-C-N 113.283 -1.781 . . . . 0.0 107.429 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -146.87 133.6 20.0 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 117.4 -1.72 . . . . 0.0 108.837 176.152 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm -122.08 112.17 17.91 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 113.88 -1.509 . . . . 0.0 107.056 177.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.9 154.63 0.7 Allowed 'General case' 0 C--N 1.381 1.943 0 CA-C-O 121.942 0.877 . . . . 0.0 112.639 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.9 p -113.26 -17.2 12.38 Favored 'General case' 0 C--N 1.36 1.035 0 CA-C-N 112.372 -2.195 . . . . 0.0 113.964 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.58 163.25 39.47 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 114.226 -1.352 . . . . 0.0 109.041 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -52.12 -30.63 27.19 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 110.709 -2.95 . . . . 0.0 115.008 -177.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 48.1 p-10 -87.97 -1.5 58.03 Favored 'General case' 0 C--N 1.358 0.971 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -177.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -109.1 160.04 16.38 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 113.835 -1.53 . . . . 0.0 108.125 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.601 HD12 ' O ' ' A' ' 18' ' ' SER . 0.4 OUTLIER -135.13 151.88 51.11 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 179.12 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.601 ' O ' HD12 ' A' ' 17' ' ' LEU . 25.9 m -83.04 168.27 17.09 Favored 'General case' 0 CA--C 1.56 1.365 0 CA-C-N 112.851 -1.977 . . . . 0.0 113.753 -178.287 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -164.08 -174.19 3.47 Favored 'General case' 0 C--N 1.354 0.766 0 CA-C-N 112.591 -2.095 . . . . 0.0 107.818 173.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.86 146.22 40.95 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 112.968 -1.924 . . . . 0.0 105.842 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -47.23 102.48 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.254 0 O-C-N 125.575 1.797 . . . . 0.0 111.537 178.508 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 127.05 -16.38 6.41 Favored Glycine 0 CA--C 1.541 1.678 0 CA-C-N 113.327 -1.76 . . . . 0.0 116.055 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -52.42 147.75 7.72 Favored 'General case' 0 C--N 1.365 1.255 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -177.033 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 88.0 mt -99.14 113.43 34.03 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 175.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.582 HD22 HD13 ' A' ' 48' ' ' ILE . 4.5 mp -107.71 160.05 16.01 Favored 'General case' 0 C--N 1.35 0.627 0 CA-C-O 122.86 1.314 . . . . 0.0 110.664 -178.325 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.4 ttmt -101.6 112.35 24.89 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 109.911 -3.313 . . . . 0.0 106.747 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.536 HG23 ' HB2' ' A' ' 3' ' ' ALA . 25.0 t -87.8 98.1 7.23 Favored 'Isoleucine or valine' 0 C--N 1.349 0.558 0 C-N-CA 113.058 -3.457 . . . . 0.0 108.494 -177.191 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.353 0.721 0 CA-C-N 112.587 -2.097 . . . . 0.0 107.185 177.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 . . . . . 0 N--CA 1.442 -0.855 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -137.97 153.94 49.4 Favored 'General case' 0 C--N 1.363 1.155 0 O-C-N 123.638 0.586 . . . . 0.0 109.997 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -130.61 151.54 50.96 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -100.72 122.17 42.91 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 178.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -143.53 168.13 20.59 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 118.736 -1.186 . . . . 0.0 113.61 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -111.59 135.16 52.55 Favored 'General case' 0 C--N 1.368 1.387 0 O-C-N 125.396 1.685 . . . . 0.0 111.13 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.572 ' HB2' HD11 ' A' ' 17' ' ' LEU 0.298 12.4 mt -162.97 143.77 9.55 Favored 'General case' 0 C--N 1.345 0.372 0 CA-C-N 110.695 -2.957 . . . . 0.0 113.93 177.773 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.58 29.62 18.71 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 110.479 -3.055 . . . . 0.0 115.501 170.524 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 75.77 18.61 79.57 Favored Glycine 0 CA--C 1.545 1.954 0 CA-C-N 114.434 -1.257 . . . . 0.0 114.088 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -138.93 171.38 14.42 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 124.828 1.251 . . . . 0.0 109.352 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -143.05 139.67 30.62 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 112.145 -2.298 . . . . 0.0 108.252 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.575 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -179.24 177.37 48.35 Favored Glycine 0 C--N 1.349 1.264 0 C-N-CA 118.977 -1.582 . . . . 0.0 112.386 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -77.68 145.92 36.34 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-N 113.311 -1.445 . . . . 0.0 110.164 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.582 HD13 HD22 ' A' ' 25' ' ' LEU . 1.6 pt -141.79 144.78 34.1 Favored Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 111.961 -2.381 . . . . 0.0 107.56 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -76.7 149.58 30.16 Favored 'Trans proline' 0 C--N 1.369 1.629 0 N-CA-C 116.028 1.511 . . . . 0.0 116.028 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.15 -49.26 62.14 Favored 'General case' 0 C--N 1.353 0.732 0 CA-C-N 112.718 -2.037 . . . . 0.0 111.434 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.253 0.7 OUTLIER -65.54 -7.58 15.33 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 117.08 -1.848 . . . . 0.0 115.92 -179.307 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.406 ' CE1' HG22 ' B' ' 5' ' ' VAL . 8.4 m-85 -93.04 -11.1 33.89 Favored 'General case' 0 C--N 1.358 0.97 0 CA-C-O 118.34 -0.838 . . . . 0.0 112.495 177.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.703 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -128.06 170.32 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-O 122.346 1.07 . . . . 0.0 108.82 178.52 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.469 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 17.7 tt0 -128.46 132.96 48.42 Favored 'General case' 0 C--N 1.354 0.775 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.532 0.265 0 CA-C-N 112.437 -2.165 . . . . 0.0 111.036 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 CA--C 1.553 1.471 0 N-CA-C 117.245 1.979 . . . . 0.0 117.245 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -59.21 160.31 19.68 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 124.341 3.361 . . . . 0.0 117.01 177.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -76.17 118.9 5.12 Favored 'Trans proline' 0 C--N 1.368 1.563 0 N-CA-C 106.314 -2.226 . . . . 0.0 106.314 174.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.445 HG12 ' HD2' ' B' ' 6' ' ' PRO . 3.1 t -62.73 147.35 93.37 Favored Pre-proline 0 CA--C 1.538 0.515 0 CA-C-N 113.001 -1.909 . . . . 0.0 109.739 -178.676 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 6' ' ' PRO . . . . . 0.445 ' HD2' HG12 ' B' ' 5' ' ' VAL . 18.1 Cg_exo -66.66 157.41 61.06 Favored 'Trans proline' 0 C--N 1.359 1.097 0 O-C-N 123.137 1.072 . . . . 0.0 114.468 178.552 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -67.69 120.88 7.9 Favored 'Trans proline' 0 C--N 1.365 1.411 0 N-CA-C 105.904 -2.383 . . . . 0.0 105.904 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.357 0.928 0 O-C-N 124.492 1.12 . . . . 0.0 110.778 -178.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.703 ' HB2' ' CG2' ' A' ' 27' ' ' VAL . . . . . . . . 0 N--CA 1.452 -0.347 0 CA-C-O 121.779 0.8 . . . . 0.0 109.362 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.1 mt -149.03 120.03 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.635 0 CA-C-N 112.297 -2.229 . . . . 0.0 108.745 -177.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 128.38 36.35 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.602 -1.635 . . . . 0.0 111.883 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.45 -24.77 15.95 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 114.42 -1.263 . . . . 0.0 113.315 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -139.89 167.61 21.72 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 118.946 -1.102 . . . . 0.0 108.781 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -67.61 145.98 54.31 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 113.725 -1.579 . . . . 0.0 108.135 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -146.66 136.5 23.27 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 122.6 1.191 . . . . 0.0 109.591 176.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.13 106.57 9.66 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 112.776 -2.011 . . . . 0.0 108.003 178.08 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.11 157.97 0.16 Allowed 'General case' 0 C--N 1.36 1.023 0 CA-C-O 122.631 1.205 . . . . 0.0 113.753 -178.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.9 p -112.84 -17.96 12.39 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 110.942 -2.845 . . . . 0.0 112.054 -177.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.71 169.02 24.34 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 123.071 1.415 . . . . 0.0 111.812 -176.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -50.53 -36.36 33.89 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 110.59 -3.004 . . . . 0.0 112.913 -179.011 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 39.3 p30 -87.38 -1.4 57.9 Favored 'General case' 0 C--N 1.356 0.851 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -107.69 157.75 17.84 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 124.368 1.042 . . . . 0.0 108.419 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.605 HD23 ' N ' ' A' ' 46' ' ' GLY . 0.3 OUTLIER -132.74 155.12 49.45 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 114.047 -1.433 . . . . 0.0 107.187 178.621 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.59 ' O ' HD12 ' A' ' 17' ' ' LEU . 4.8 m -84.3 171.5 12.65 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 123.661 1.696 . . . . 0.0 114.055 -178.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -167.43 163.62 14.98 Favored 'General case' 0 C--N 1.347 0.465 0 CA-C-N 111.364 -2.653 . . . . 0.0 107.976 174.319 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -127.39 141.06 51.79 Favored 'General case' 0 C--O 1.223 -0.316 0 N-CA-C 105.45 -2.055 . . . . 0.0 105.45 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -40.81 99.63 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.061 0 O-C-N 125.986 2.054 . . . . 0.0 113.843 -176.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 129.55 -7.75 6.21 Favored Glycine 0 C--N 1.36 1.884 0 CA-C-N 113.562 -1.654 . . . . 0.0 116.115 178.312 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.573 ' HB3' HD21 ' A' ' 41' ' ' LEU . 11.2 m-20 -61.61 146.76 47.92 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 117.334 -1.746 . . . . 0.0 112.783 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 26.6 mm -99.08 112.85 32.3 Favored 'Isoleucine or valine' 0 C--N 1.347 0.474 0 N-CA-C 104.516 -2.401 . . . . 0.0 104.516 177.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.692 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 5.1 mp -107.16 160.92 15.21 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 118.301 -1.36 . . . . 0.0 111.693 -175.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.08 113.97 27.89 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 110.403 -3.089 . . . . 0.0 107.737 177.798 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.703 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 57.5 t -85.86 121.29 37.13 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 C-N-CA 116.486 -2.086 . . . . 0.0 106.885 -177.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 27.2 tp . . . . . 0 C--N 1.345 0.39 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.581 -175.961 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.1 m-20 . . . . . 0 CA--C 1.551 0.99 0 CA-C-O 118.448 -0.787 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.8 m95 -136.91 153.28 50.78 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -178.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -127.02 147.97 50.13 Favored 'General case' 0 C--N 1.355 0.846 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 178.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -102.03 116.28 32.35 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 104.133 -2.544 . . . . 0.0 104.133 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.38 173.74 11.29 Favored 'General case' 0 C--N 1.349 0.574 0 C-N-CA 119.086 -1.046 . . . . 0.0 111.154 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -109.26 141.83 41.0 Favored 'General case' 0 C--N 1.359 1.003 0 O-C-N 125.64 1.837 . . . . 0.0 110.675 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.573 HD21 ' HB3' ' A' ' 23' ' ' ASP . 8.3 mt -158.66 119.47 3.33 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 110.575 -3.011 . . . . 0.0 115.76 179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.367 0.0 OUTLIER 61.87 33.17 17.74 Favored 'General case' 0 C--N 1.384 2.092 1 C-N-CA 110.051 -4.66 . . . . 0.0 118.564 173.671 . . . . . . . . 4 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.62 22.39 59.28 Favored Glycine 0 CA--C 1.546 2.022 0 C-N-CA 116.227 -2.892 . . . . 0.0 112.384 -178.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.45 137.22 47.18 Favored 'General case' 0 C--N 1.353 0.72 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 179.424 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 18.4 p-10 -130.17 145.77 51.75 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 -178.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.605 ' N ' HD23 ' A' ' 17' ' ' LEU . . . 176.19 178.79 46.25 Favored Glycine 0 C--N 1.34 0.769 0 C-N-CA 116.313 -2.851 . . . . 0.0 112.388 -178.5 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -76.93 143.03 39.82 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-O 123.414 1.578 . . . . 0.0 109.331 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.2 pt -143.37 144.19 27.12 Favored Pre-proline 0 C--O 1.218 -0.556 0 CA-C-N 111.412 -2.631 . . . . 0.0 106.195 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -77.09 147.53 26.58 Favored 'Trans proline' 0 C--N 1.356 0.968 0 N-CA-C 116.237 1.591 . . . . 0.0 116.237 -177.172 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.14 -45.76 66.14 Favored 'General case' 0 C--N 1.358 0.938 0 C-N-CA 116.922 -1.911 . . . . 0.0 110.843 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.313 0.5 OUTLIER -62.6 -7.38 4.64 Favored 'General case' 0 CA--C 1.557 1.235 0 C-N-CA 115.137 -2.625 . . . . 0.0 115.617 -177.838 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.704 ' CE1' HG22 ' B' ' 5' ' ' VAL . 6.8 m-85 -93.42 -10.52 34.86 Favored 'General case' 0 CA--C 1.559 1.302 0 CA-C-O 118.738 -0.648 . . . . 0.0 111.611 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.703 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -127.3 168.85 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-O 122.314 1.054 . . . . 0.0 108.707 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.433 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 3.5 tt0 -120.94 136.66 54.91 Favored 'General case' 0 C--N 1.352 0.694 0 N-CA-C 103.11 -2.922 . . . . 0.0 103.11 176.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.224 -0.248 0 CA-C-N 113.233 -1.803 . . . . 0.0 110.212 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.436 -1.91 0 N-CA-C 115.563 1.332 . . . . 0.0 115.563 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -58.95 158.41 25.17 Favored 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 122.36 2.04 . . . . 0.0 115.89 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -70.14 119.57 6.47 Favored 'Trans proline' 0 C--N 1.362 1.271 0 N-CA-C 106.07 -2.319 . . . . 0.0 106.07 175.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.704 HG22 ' CE1' ' A' ' 52' ' ' TYR . 16.6 t -64.63 149.34 95.76 Favored Pre-proline 0 CA--C 1.543 0.7 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.995 -177.227 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 6' ' ' PRO . . . . . 0.403 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 20.2 Cg_exo -66.05 158.66 53.22 Favored 'Trans proline' 0 C--N 1.362 1.256 0 O-C-N 123.052 1.027 . . . . 0.0 114.361 178.163 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -78.89 118.52 4.12 Favored 'Trans proline' 0 C--N 1.358 1.027 0 N-CA-C 106.549 -2.135 . . . . 0.0 106.549 176.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.352 0.694 0 C-N-CA 117.287 -1.765 . . . . 0.0 109.2 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.629 ' HB2' ' CG2' ' A' ' 27' ' ' VAL . . . . . . . . 0 N--CA 1.449 -0.491 0 CA-C-O 122.935 1.35 . . . . 0.0 108.68 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.275 16.4 mm -145.47 118.39 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-N 110.587 -3.006 . . . . 0.0 108.888 -176.157 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.552 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -68.45 125.54 26.81 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 117.054 -1.858 . . . . 0.0 107.83 176.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.8 mtmt -95.2 -24.89 16.61 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.519 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 52.2 m-85 -141.46 167.41 22.23 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -67.93 147.0 53.07 Favored 'General case' 0 C--N 1.352 0.698 0 CA-C-N 114.049 -1.432 . . . . 0.0 107.494 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -147.37 129.64 15.66 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 116.819 -1.952 . . . . 0.0 110.214 176.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.406 ' H ' ' HD3' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -121.5 116.42 24.66 Favored 'General case' 0 CA--C 1.569 1.687 0 CA-C-N 113.699 -1.591 . . . . 0.0 107.407 177.543 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.58 159.87 0.09 Allowed 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 123.537 1.637 . . . . 0.0 115.185 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 28.4 p -119.14 -15.64 9.19 Favored 'General case' 0 C--N 1.353 0.751 0 CA-C-N 110.162 -3.199 . . . . 0.0 114.057 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.09 160.45 43.43 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 123.052 1.406 . . . . 0.0 111.443 -178.158 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -49.28 -32.2 10.42 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-N 111.066 -2.788 . . . . 0.0 113.462 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -89.32 -2.16 58.34 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.988 1.847 . . . . 0.0 115.988 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -106.89 162.82 13.48 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 114.051 -1.432 . . . . 0.0 107.761 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.637 HD12 ' O ' ' A' ' 18' ' ' SER . 0.4 OUTLIER -134.58 152.4 51.75 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.058 -1.428 . . . . 0.0 107.824 179.443 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.637 ' O ' HD12 ' A' ' 17' ' ' LEU . 4.2 m -85.0 164.76 18.07 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 124.31 2.005 . . . . 0.0 113.048 -178.115 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -162.16 178.59 8.63 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 111.431 -2.622 . . . . 0.0 108.168 173.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.19 145.98 44.35 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 111.853 -2.431 . . . . 0.0 104.723 -178.28 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -47.48 100.43 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 O-C-N 125.69 1.869 . . . . 0.0 112.191 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.552 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 130.59 -14.7 5.54 Favored Glycine 0 C--N 1.353 1.482 0 CA-C-O 118.634 -1.092 . . . . 0.0 115.548 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.684 ' HB3' HD21 ' A' ' 41' ' ' LEU . 37.5 m-20 -53.71 146.09 14.19 Favored 'General case' 0 C--N 1.365 1.269 0 C-N-CA 118.746 -1.182 . . . . 0.0 112.289 -179.46 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.3 mm -95.6 116.45 37.28 Favored 'Isoleucine or valine' 0 C--N 1.352 0.688 0 N-CA-C 100.876 -3.75 . . . . 0.0 100.876 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.596 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 0.6 OUTLIER -106.61 153.19 22.72 Favored 'General case' 0 C--N 1.348 0.52 0 CA-C-N 113.174 -1.83 . . . . 0.0 111.363 -175.345 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -104.58 109.06 20.81 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 109.798 -3.364 . . . . 0.0 109.288 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.629 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 55.8 t -86.92 110.31 20.18 Favored 'Isoleucine or valine' 0 C--N 1.344 0.356 0 C-N-CA 116.687 -2.005 . . . . 0.0 110.065 -176.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.2 tp . . . . . 0 CA--C 1.551 0.984 0 CA-C-N 112.792 -2.003 . . . . 0.0 109.325 179.903 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 . . . . . 0 N--CA 1.436 -1.135 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -135.21 159.27 42.07 Favored 'General case' 0 CA--C 1.553 1.069 0 O-C-N 124.82 1.325 . . . . 0.0 109.218 -179.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -134.96 148.23 49.96 Favored 'General case' 0 C--N 1.354 0.78 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.5 ttpp -99.89 117.92 35.22 Favored 'General case' 0 C--N 1.354 0.799 0 N-CA-C 104.442 -2.429 . . . . 0.0 104.442 177.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.48 176.84 8.38 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 113.815 -1.539 . . . . 0.0 111.061 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -126.61 143.79 51.11 Favored 'General case' 0 C--N 1.356 0.871 0 O-C-N 125.33 1.644 . . . . 0.0 110.856 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.684 HD21 ' HB3' ' A' ' 23' ' ' ASP 0.289 10.8 mt -161.9 142.62 10.61 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 109.766 -3.379 . . . . 0.0 113.084 178.982 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.94 30.3 18.93 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 111.544 -2.571 . . . . 0.0 116.352 170.304 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.95 11.61 85.23 Favored Glycine 0 CA--C 1.545 1.95 0 C-N-CA 119.305 -1.426 . . . . 0.0 114.975 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -136.08 165.24 26.16 Favored 'General case' 0 C--N 1.352 0.689 0 C-N-CA 124.448 1.099 . . . . 0.0 108.055 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -139.44 139.06 36.96 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 112.84 -1.982 . . . . 0.0 108.011 -179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.535 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -172.48 178.26 44.67 Favored Glycine 0 C--N 1.344 0.988 0 C-N-CA 118.105 -1.998 . . . . 0.0 111.707 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -77.78 146.0 36.09 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 112.628 -1.786 . . . . 0.0 110.369 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.537 HD13 HD22 ' A' ' 25' ' ' LEU . 35.0 pt -141.88 143.27 27.95 Favored Pre-proline 0 C--N 1.349 0.551 0 CA-C-N 112.128 -2.306 . . . . 0.0 106.023 178.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -75.1 139.42 24.0 Favored 'Trans proline' 0 C--N 1.362 1.273 0 CA-C-N 118.972 0.669 . . . . 0.0 112.664 -178.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.7 pttp -70.05 -21.13 63.2 Favored 'General case' 0 C--N 1.358 0.974 0 C-N-CA 114.761 -2.776 . . . . 0.0 112.978 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.62 -18.9 61.55 Favored 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 113.544 -3.262 . . . . 0.0 111.329 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -87.54 -6.87 58.15 Favored 'General case' 0 C--N 1.367 1.358 0 O-C-N 123.851 0.719 . . . . 0.0 112.528 -175.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.605 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -129.76 172.28 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 CA-C-O 121.893 0.854 . . . . 0.0 108.827 177.75 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.459 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 2.4 tt0 -132.87 136.22 46.08 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 112.848 -1.978 . . . . 0.0 105.938 177.457 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 55.2 mtm . . . . . 0 CA--C 1.538 0.506 0 CA-C-N 112.721 -2.036 . . . . 0.0 110.736 -179.18 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 2' ' ' PRO . . . . . 0.519 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 1.9 Cg_endo . . . . . 0 CA--C 1.564 2.013 0 N-CA-C 115.007 1.118 . . . . 0.0 115.007 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' B' ' 2' ' ' PRO . 75.2 Cg_exo -57.69 158.12 21.16 Favored 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 124.056 3.17 . . . . 0.0 117.627 179.187 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -71.61 114.05 3.83 Favored 'Trans proline' 0 C--N 1.357 0.989 0 N-CA-C 106.885 -2.006 . . . . 0.0 106.885 175.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.434 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.1 t -54.58 148.27 26.25 Favored Pre-proline 0 C--N 1.354 0.782 0 CA-C-N 113.473 -1.694 . . . . 0.0 109.864 -178.674 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 6' ' ' PRO . . . . . 0.434 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 21.0 Cg_exo -64.38 153.83 74.7 Favored 'Trans proline' 0 C--N 1.359 1.129 0 N-CA-C 114.977 1.107 . . . . 0.0 114.977 178.792 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -76.63 111.05 3.17 Favored 'Trans proline' 0 C--N 1.362 1.242 0 N-CA-C 107.462 -1.784 . . . . 0.0 107.462 176.328 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? . . . . . 0 C--N 1.349 0.544 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.395 -179.476 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.959 ' HB1' HD11 ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.451 -0.422 0 N-CA-C 105.287 -2.116 . . . . 0.0 105.287 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 mt -154.43 134.35 3.97 Favored 'Isoleucine or valine' 0 C--N 1.348 0.508 0 C-N-CA 117.553 -1.659 . . . . 0.0 109.59 -175.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.526 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -66.92 129.45 39.94 Favored 'General case' 0 CA--C 1.557 1.214 0 CA-C-N 112.504 -2.135 . . . . 0.0 109.596 177.138 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -97.44 -27.19 14.56 Favored 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 113.839 -1.528 . . . . 0.0 111.954 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.422 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 65.0 m-85 -142.44 170.46 15.66 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 113.32 -1.763 . . . . 0.0 106.956 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.32 142.87 47.1 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 118.807 -1.157 . . . . 0.0 108.413 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -147.18 127.17 13.63 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 117.418 -1.713 . . . . 0.0 111.225 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.94 118.78 33.9 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 112.763 -2.017 . . . . 0.0 108.142 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.85 151.53 1.2 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 122.181 0.991 . . . . 0.0 112.216 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.79 -11.0 9.06 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-N 112.06 -2.336 . . . . 0.0 112.126 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.43 164.99 37.21 Favored 'General case' 0 C--N 1.356 0.885 0 CA-C-O 123.847 1.784 . . . . 0.0 110.338 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -47.77 -34.67 8.81 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 108.842 -3.799 . . . . 0.0 114.697 -178.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -93.87 0.68 56.31 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 26.7 mp0 -112.97 154.55 26.27 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.399 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.441 HD23 ' C ' ' A' ' 45' ' ' ASP . 1.9 pp -134.54 154.92 51.22 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 112.807 -1.997 . . . . 0.0 109.854 177.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . 0.255 58.5 m -82.1 166.7 19.48 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 111.213 -2.721 . . . . 0.0 113.143 -177.159 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.9 p90 -163.9 -175.95 4.32 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 110.248 -3.16 . . . . 0.0 107.419 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.8 143.82 37.05 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 111.918 -2.401 . . . . 0.0 105.509 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -46.67 98.57 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.441 0 O-C-N 125.168 1.543 . . . . 0.0 112.866 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.526 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 131.11 -13.28 5.5 Favored Glycine 0 C--N 1.356 1.66 0 O-C-N 124.525 1.14 . . . . 0.0 115.535 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.457 ' HB3' HD21 ' A' ' 41' ' ' LEU . 1.8 m-20 -54.52 145.77 17.8 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 119.109 -1.037 . . . . 0.0 112.684 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.8 mm -97.0 117.0 40.74 Favored 'Isoleucine or valine' 0 C--N 1.352 0.686 0 N-CA-C 103.09 -2.93 . . . . 0.0 103.09 177.013 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.464 HD21 ' CD1' ' A' ' 41' ' ' LEU . 0.6 OUTLIER -111.04 148.48 32.52 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 112.173 -2.285 . . . . 0.0 112.542 -175.714 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.14 107.54 18.56 Favored 'General case' 0 C--O 1.213 -0.832 0 CA-C-N 110.705 -2.952 . . . . 0.0 108.475 178.153 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.414 HG13 ' CB ' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -86.34 99.0 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 C-N-CA 115.133 -2.627 . . . . 0.0 109.778 -176.814 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.1 tp . . . . . 0 C--N 1.344 0.357 0 CA-C-N 110.509 -3.041 . . . . 0.0 107.292 178.824 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 58.9 m-80 . . . . . 0 N--CA 1.436 -1.125 0 N-CA-C 115.288 1.588 . . . . 0.0 115.288 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.432 ' CE2' ' HB3' ' B' ' 8' ' ' ARG . 70.5 m95 -132.55 153.98 50.44 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 119.053 0.842 . . . . 0.0 110.929 -178.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.436 ' O ' ' HA ' ' A' ' 47' ' ' PHE 0.261 21.4 m-85 -133.46 148.51 51.74 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 114.595 -1.184 . . . . 0.0 108.514 177.634 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -99.19 119.35 37.72 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 179.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.04 172.54 12.54 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 119.181 -1.008 . . . . 0.0 112.162 -176.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -113.7 134.39 54.78 Favored 'General case' 0 C--N 1.362 1.139 0 O-C-N 125.15 1.531 . . . . 0.0 111.915 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.464 ' CD1' HD21 ' A' ' 25' ' ' LEU 0.342 9.4 mt -161.2 137.55 8.35 Favored 'General case' 0 C--N 1.355 0.813 0 CA-C-N 111.662 -2.517 . . . . 0.0 114.565 178.778 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.9 21.14 5.85 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 110.218 -3.174 . . . . 0.0 116.661 170.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 91.96 15.22 54.87 Favored Glycine 0 C--N 1.353 1.486 0 CA-C-N 114.359 -1.292 . . . . 0.0 113.287 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -134.3 166.74 22.11 Favored 'General case' 0 C--N 1.354 0.773 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.441 ' C ' HD23 ' A' ' 17' ' ' LEU . 5.6 p-10 -141.96 129.64 21.56 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 112.773 -2.012 . . . . 0.0 107.546 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.49 178.56 44.53 Favored Glycine 0 C--N 1.353 1.493 0 C-N-CA 119.318 -1.42 . . . . 0.0 111.995 -177.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PHE . . . . . 0.436 ' HA ' ' O ' ' A' ' 37' ' ' TYR . 69.3 m-85 -77.86 146.28 35.77 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 123.062 1.411 . . . . 0.0 113.481 -178.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.2 pt -141.18 144.15 33.54 Favored Pre-proline 0 C--N 1.354 0.788 0 CA-C-N 111.21 -2.723 . . . . 0.0 107.104 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.13 150.49 37.7 Favored 'Trans proline' 0 C--N 1.364 1.383 0 N-CA-C 116.327 1.626 . . . . 0.0 116.327 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . 0.342 0.1 OUTLIER -65.97 -45.39 81.87 Favored 'General case' 0 C--N 1.364 1.227 0 CA-C-N 114.043 -1.435 . . . . 0.0 111.446 179.622 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.319 5.2 p30 -68.66 -11.89 60.7 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 116.116 -2.234 . . . . 0.0 114.306 -178.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.445 ' CE1' HG22 ' B' ' 5' ' ' VAL . 9.2 m-85 -92.44 -12.56 31.79 Favored 'General case' 0 C--N 1.357 0.924 0 CA-C-O 117.754 -1.117 . . . . 0.0 112.374 177.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.959 HD11 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -133.14 168.67 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-O 122.303 1.049 . . . . 0.0 109.2 178.925 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.456 ' N ' HG13 ' A' ' 53' ' ' ILE . 2.0 tt0 -136.92 137.63 39.78 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 113.185 -1.825 . . . . 0.0 107.823 176.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.2 mtm . . . . . 0 C--N 1.349 0.579 0 CA-C-N 113.707 -1.588 . . . . 0.0 109.072 178.78 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 2' ' ' PRO . . . . . 0.422 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 5.8 Cg_exo . . . . . 0 N--CA 1.445 -1.365 0 N-CA-C 114.337 0.86 . . . . 0.0 114.337 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -51.83 160.19 3.08 Favored 'Trans proline' 0 C--N 1.364 1.379 0 C-N-CA 122.652 2.235 . . . . 0.0 116.999 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -72.97 126.73 11.5 Favored 'Trans proline' 0 C--N 1.367 1.525 0 N-CA-C 105.762 -2.438 . . . . 0.0 105.762 175.052 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.445 HG22 ' CE1' ' A' ' 52' ' ' TYR . 10.7 t -70.74 146.71 93.8 Favored Pre-proline 0 CA--C 1.54 0.584 0 C-N-CA 117.688 -1.605 . . . . 0.0 108.92 -177.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 6' ' ' PRO . . . . . 0.416 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 12.5 Cg_exo -67.9 160.08 50.02 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 O-C-N 123.358 1.188 . . . . 0.0 114.806 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -78.57 116.54 3.83 Favored 'Trans proline' 0 CA--C 1.551 1.329 0 N-CA-C 108.405 -1.421 . . . . 0.0 108.405 176.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.432 ' HB3' ' CE2' ' A' ' 36' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.352 0.686 0 CA-C-N 114.304 -1.316 . . . . 0.0 108.865 179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.641 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.444 -0.769 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.1 mt -148.98 120.93 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 111.381 -2.645 . . . . 0.0 108.23 -176.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.96 134.08 49.05 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 113.325 -1.761 . . . . 0.0 108.401 176.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt -94.22 -22.3 18.5 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 124.415 1.086 . . . . 0.0 112.563 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.429 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 88.0 m-85 -142.33 170.29 15.98 Favored 'General case' 0 C--N 1.35 0.611 0 CA-C-N 113.935 -1.484 . . . . 0.0 108.394 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -72.51 149.29 44.24 Favored 'General case' 0 C--O 1.214 -0.8 0 CA-C-N 113.348 -1.751 . . . . 0.0 108.017 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.443 ' HE1' HG21 ' B' ' 5' ' ' VAL . 26.6 t80 -145.95 134.61 22.23 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 117.693 -1.603 . . . . 0.0 109.409 176.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -122.37 101.25 7.39 Favored 'General case' 0 CA--C 1.561 1.373 0 CA-C-N 111.694 -2.503 . . . . 0.0 109.773 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.55 152.69 0.89 Allowed 'General case' 0 C--N 1.362 1.131 0 CA-C-O 122.123 0.963 . . . . 0.0 113.028 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.1 p -118.84 -11.81 9.7 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-N 111.848 -2.433 . . . . 0.0 113.156 -177.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.22 163.58 38.53 Favored 'General case' 0 C--N 1.355 0.809 0 CA-C-O 123.323 1.535 . . . . 0.0 110.201 -178.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -49.08 -31.35 7.75 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 110.332 -3.122 . . . . 0.0 115.343 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 57.4 p30 -90.74 -4.13 56.93 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -109.77 158.09 18.48 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 113.693 -1.594 . . . . 0.0 107.791 -179.381 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.576 HD12 ' O ' ' A' ' 18' ' ' SER . 0.4 OUTLIER -133.41 152.22 51.89 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 111.624 -2.535 . . . . 0.0 108.134 178.441 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.576 ' O ' HD12 ' A' ' 17' ' ' LEU . 13.3 m -82.94 166.09 19.16 Favored 'General case' 0 C--N 1.354 0.765 0 CA-C-N 112.516 -2.129 . . . . 0.0 112.65 -178.15 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -163.7 -175.21 4.02 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 111.145 -2.752 . . . . 0.0 107.646 172.197 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -139.37 147.31 41.33 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.93 100.72 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.031 0 O-C-N 125.269 1.605 . . . . 0.0 112.651 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 129.7 -19.01 5.34 Favored Glycine 0 C--N 1.353 1.476 0 CA-C-O 117.94 -1.478 . . . . 0.0 115.415 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.467 ' HB3' HD21 ' A' ' 41' ' ' LEU . 76.8 m-20 -47.73 149.93 1.15 Allowed 'General case' 0 C--N 1.366 1.325 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -177.615 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mm -97.14 112.65 29.63 Favored 'Isoleucine or valine' 0 C--N 1.35 0.59 0 N-CA-C 103.54 -2.763 . . . . 0.0 103.54 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.849 HD11 HD11 ' A' ' 41' ' ' LEU . 3.1 mp -108.79 146.47 33.55 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-N 114.083 -1.417 . . . . 0.0 111.992 -175.332 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.34 112.49 25.4 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-N 111.877 -2.419 . . . . 0.0 107.546 179.175 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.629 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 12.0 t -87.87 99.58 8.98 Favored 'Isoleucine or valine' 0 C--N 1.352 0.679 0 C-N-CA 114.015 -3.074 . . . . 0.0 110.954 -175.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.7 mm? . . . . . 0 C--N 1.358 0.938 0 CA-C-N 112.976 -1.92 . . . . 0.0 106.009 177.115 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 43.4 m-20 . . . . . 0 N--CA 1.442 -0.856 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -134.03 155.82 49.32 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -136.17 153.61 51.21 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 114.05 -1.432 . . . . 0.0 108.514 177.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.9 ttmt -100.69 123.45 44.91 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 106.525 -1.658 . . . . 0.0 106.525 177.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -142.05 173.44 11.52 Favored 'General case' 0 C--N 1.352 0.677 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.683 -178.156 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 50.8 tt0 -120.92 136.66 54.9 Favored 'General case' 0 C--N 1.367 1.339 0 O-C-N 124.939 1.399 . . . . 0.0 111.062 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.849 HD11 HD11 ' A' ' 25' ' ' LEU 0.264 12.3 mt -160.34 142.38 12.82 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 110.222 -3.172 . . . . 0.0 113.655 178.733 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.03 24.66 9.81 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 109.08 -3.691 . . . . 0.0 115.62 171.297 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.03 14.49 66.89 Favored Glycine 0 C--N 1.357 1.726 0 CA-C-N 114.64 -1.163 . . . . 0.0 113.867 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -134.35 168.13 19.47 Favored 'General case' 0 C--N 1.35 0.605 0 C-N-CA 125.013 1.325 . . . . 0.0 108.662 -179.385 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -139.49 141.51 37.35 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 112.401 -2.181 . . . . 0.0 107.74 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.568 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -177.91 177.95 48.42 Favored Glycine 0 C--N 1.348 1.227 0 C-N-CA 118.268 -1.92 . . . . 0.0 112.755 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -77.94 143.35 37.73 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 112.759 -1.72 . . . . 0.0 111.302 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.5 pt -141.89 143.39 28.4 Favored Pre-proline 0 C--N 1.351 0.662 0 CA-C-N 111.597 -2.547 . . . . 0.0 106.611 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -78.45 151.29 25.75 Favored 'Trans proline' 0 C--N 1.364 1.352 0 N-CA-C 116.775 1.798 . . . . 0.0 116.775 -177.04 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -44.12 81.93 Favored 'General case' 0 C--N 1.365 1.275 0 C-N-CA 118.159 -1.416 . . . . 0.0 112.002 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.323 0.7 OUTLIER -66.2 -10.77 44.89 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 116.263 -2.175 . . . . 0.0 115.839 -178.787 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.657 ' CE1' HG22 ' B' ' 5' ' ' VAL . 7.8 m-85 -93.96 -10.55 33.33 Favored 'General case' 0 C--N 1.357 0.923 0 CA-C-O 117.356 -1.307 . . . . 0.0 110.911 177.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.641 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -129.95 169.75 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 CA-C-O 123.071 1.415 . . . . 0.0 109.778 179.211 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.5 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 28.2 tt0 -135.35 133.51 38.84 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 111.179 -2.737 . . . . 0.0 106.198 177.029 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 38.0 mtp . . . . . 0 C--N 1.353 0.748 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.824 -179.699 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 2' ' ' PRO . . . . . 0.429 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 5.6 Cg_exo . . . . . 0 N--CA 1.443 -1.454 0 CA-C-O 121.543 0.56 . . . . 0.0 112.297 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -49.87 156.13 3.57 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.224 1.949 . . . . 0.0 115.846 178.566 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -70.43 128.06 14.9 Favored 'Trans proline' 0 C--N 1.365 1.435 0 N-CA-C 107.011 -1.957 . . . . 0.0 107.011 176.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.657 HG22 ' CE1' ' A' ' 52' ' ' TYR . 13.3 t -73.59 145.95 85.39 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-N 113.92 -1.491 . . . . 0.0 108.511 -177.192 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -64.35 158.47 48.82 Favored 'Trans proline' 0 C--N 1.358 1.072 0 O-C-N 123.3 1.158 . . . . 0.0 114.535 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.55 118.38 5.48 Favored 'Trans proline' 0 C--N 1.36 1.136 0 N-CA-C 108.453 -1.403 . . . . 0.0 108.453 176.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.353 0.733 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.515 ' HB1' ' CD1' ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.447 -0.598 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.26 20.8 mt -147.19 116.19 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-N 111.963 -2.38 . . . . 0.0 109.305 -176.202 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.627 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -68.85 123.29 20.57 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 118.333 -1.347 . . . . 0.0 108.301 176.26 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -95.77 -23.56 16.9 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -141.16 163.32 33.28 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 125.355 1.659 . . . . 0.0 106.996 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -65.08 147.01 54.25 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 113.509 -1.678 . . . . 0.0 109.354 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -144.3 136.89 26.79 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 117.38 -1.728 . . . . 0.0 109.662 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -123.97 102.52 7.81 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 112.748 -2.024 . . . . 0.0 110.192 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.62 152.63 0.92 Allowed 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.381 1.086 . . . . 0.0 112.222 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.9 p -114.65 -14.42 12.05 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 111.464 -2.607 . . . . 0.0 114.306 -177.778 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -150.77 167.52 27.17 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-O 123.326 1.536 . . . . 0.0 110.049 -177.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -54.74 -30.48 56.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 110.018 -3.265 . . . . 0.0 113.907 -178.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 59.3 p30 -91.96 -2.8 56.57 Favored 'General case' 0 C--N 1.353 0.741 0 N-CA-C 114.857 1.429 . . . . 0.0 114.857 -177.571 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -108.84 156.01 20.14 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 125.012 1.445 . . . . 0.0 108.411 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.642 HD23 ' N ' ' A' ' 46' ' ' GLY . 0.3 OUTLIER -135.35 152.73 51.73 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 113.66 -1.609 . . . . 0.0 107.146 179.071 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.525 ' O ' HD12 ' A' ' 17' ' ' LEU . 25.0 m -83.0 166.69 18.6 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 112.805 -1.998 . . . . 0.0 113.636 -178.139 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -164.04 174.25 11.57 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-N 112.4 -2.182 . . . . 0.0 107.887 174.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 11.5 pttt -139.48 122.44 16.69 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 113.191 -1.822 . . . . 0.0 108.497 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -19.43 64.95 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 129.931 3.292 . . . . 0.0 118.29 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.627 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 158.87 -12.49 0.21 Allowed Glycine 0 CA--C 1.528 0.858 0 CA-C-N 112.452 -2.158 . . . . 0.0 114.622 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.417 ' HB3' HD21 ' A' ' 41' ' ' LEU . 41.7 m-20 -50.48 147.56 4.42 Favored 'General case' 0 C--N 1.36 1.041 0 CA-C-O 122.52 1.153 . . . . 0.0 113.414 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 70.1 mt -97.35 108.55 21.78 Favored 'Isoleucine or valine' 0 C--N 1.35 0.605 0 N-CA-C 101.618 -3.475 . . . . 0.0 101.618 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.507 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 0.5 OUTLIER -108.22 157.29 18.46 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 111.683 -2.508 . . . . 0.0 111.57 -176.413 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -106.9 103.82 13.34 Favored 'General case' 0 C--O 1.215 -0.717 0 CA-C-N 110.508 -3.042 . . . . 0.0 109.639 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.416 HG23 ' HB2' ' A' ' 3' ' ' ALA . 2.3 t -85.52 113.15 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 C-N-CA 116.71 -1.996 . . . . 0.0 106.663 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 tp . . . . . 0 CA--C 1.553 1.08 0 CA-C-N 112.712 -2.04 . . . . 0.0 107.702 179.352 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 . . . . . 0 CA--C 1.545 0.764 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -136.25 155.76 49.64 Favored 'General case' 0 C--N 1.351 0.673 0 O-C-N 124.15 0.906 . . . . 0.0 108.57 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -136.29 149.7 48.56 Favored 'General case' 0 C--N 1.351 0.663 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 176.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -98.25 120.6 38.93 Favored 'General case' 0 C--N 1.347 0.487 0 N-CA-C 102.101 -3.296 . . . . 0.0 102.101 177.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.99 172.61 12.6 Favored 'General case' 0 C--N 1.348 0.524 0 C-N-CA 118.074 -1.45 . . . . 0.0 112.062 -175.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -125.6 142.04 51.71 Favored 'General case' 0 C--N 1.356 0.861 0 CA-C-N 112.532 -2.122 . . . . 0.0 112.104 -177.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.444 ' HB2' HD11 ' A' ' 17' ' ' LEU . 4.2 mt -158.88 125.17 4.56 Favored 'General case' 0 C--O 1.222 -0.371 1 CA-C-N 108.337 -4.029 . . . . 0.0 115.041 -179.573 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.341 0.0 OUTLIER 61.06 28.98 18.67 Favored 'General case' 0 C--N 1.358 0.943 0 N-CA-C 119.557 3.169 . . . . 0.0 119.557 171.18 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 68.67 22.97 75.53 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 119.694 -1.241 . . . . 0.0 111.909 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -131.08 142.37 50.27 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 111.126 -2.537 . . . . 0.0 105.37 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -139.67 140.7 36.95 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 113.31 -1.768 . . . . 0.0 107.589 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.642 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -177.19 176.84 48.23 Favored Glycine 0 C--N 1.346 1.089 0 C-N-CA 118.651 -1.738 . . . . 0.0 111.901 -179.041 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -77.92 141.99 38.69 Favored 'General case' 0 C--N 1.35 0.606 0 CA-C-N 112.732 -1.734 . . . . 0.0 109.057 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 22.9 pt -142.12 148.17 47.2 Favored Pre-proline 0 N--CA 1.45 -0.454 0 CA-C-N 110.903 -2.862 . . . . 0.0 106.033 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -77.68 138.29 16.93 Favored 'Trans proline' 0 C--N 1.363 1.337 0 N-CA-C 114.066 0.756 . . . . 0.0 114.066 -177.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -33.51 71.89 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 117.315 -1.754 . . . . 0.0 112.549 -177.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.32 0.6 OUTLIER -70.01 -8.45 49.22 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 116.833 -1.947 . . . . 0.0 114.133 179.092 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.419 ' CE1' HG22 ' B' ' 5' ' ' VAL . 6.0 m-85 -93.01 -13.19 29.01 Favored 'General case' 0 CA--C 1.559 1.308 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 176.637 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.515 ' CD1' ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -128.88 170.62 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 CA-C-O 122.572 1.177 . . . . 0.0 109.736 179.606 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.491 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 2.8 tp10 -123.66 145.19 49.14 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 103.732 -2.692 . . . . 0.0 103.732 176.69 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . 0.275 38.5 mtm . . . . . 0 C--N 1.342 0.266 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -176.279 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo . . . . . 0 CA--C 1.554 1.495 0 N-CA-C 114.204 0.809 . . . . 0.0 114.204 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -54.71 160.94 6.63 Favored 'Trans proline' 0 C--N 1.368 1.575 0 C-N-CA 123.358 2.705 . . . . 0.0 116.997 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -73.51 127.93 12.23 Favored 'Trans proline' 0 C--N 1.371 1.757 0 N-CA-C 105.561 -2.515 . . . . 0.0 105.561 174.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.487 HG12 ' HD2' ' B' ' 6' ' ' PRO . 2.7 t -73.19 147.22 87.79 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-N 114.026 -1.443 . . . . 0.0 108.868 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 6' ' ' PRO . . . . . 0.487 ' HD2' HG12 ' B' ' 5' ' ' VAL . 13.4 Cg_exo -67.49 156.29 66.73 Favored 'Trans proline' 0 N--CA 1.45 -1.073 0 N-CA-C 115.69 1.381 . . . . 0.0 115.69 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -65.78 123.1 10.88 Favored 'Trans proline' 0 C--N 1.365 1.438 0 N-CA-C 107.347 -1.828 . . . . 0.0 107.347 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.848 0 CA-C-O 122.989 1.376 . . . . 0.0 110.831 -177.568 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.608 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.443 -0.824 0 CA-C-O 123.057 1.408 . . . . 0.0 108.323 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.251 44.3 mt -146.99 115.49 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.848 0 CA-C-N 109.931 -3.304 . . . . 0.0 109.423 -176.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.57 125.16 25.65 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 176.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.2 mtmt -95.45 -23.56 17.07 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 114.591 -1.186 . . . . 0.0 113.635 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -140.75 169.06 18.34 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 107.057 -1.46 . . . . 0.0 107.057 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -68.94 150.79 47.32 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.89 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -147.64 130.65 16.27 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 116.712 -1.995 . . . . 0.0 109.476 175.419 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.07 103.2 8.15 Favored 'General case' 0 CA--C 1.556 1.198 0 N-CA-C 106.088 -1.819 . . . . 0.0 106.088 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.82 154.38 0.33 Allowed 'General case' 0 C--N 1.375 1.696 0 O-C-N 124.717 1.261 . . . . 0.0 113.787 -178.052 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.0 p -111.66 -15.52 13.43 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-N 111.772 -2.467 . . . . 0.0 112.167 -177.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.42 163.12 40.16 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 123.123 1.439 . . . . 0.0 110.052 -178.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -51.71 -34.24 37.93 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 110.733 -2.94 . . . . 0.0 115.263 -176.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -89.1 0.1 56.99 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 118.383 -1.327 . . . . 0.0 114.501 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.06 159.5 16.25 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 113.013 -1.903 . . . . 0.0 106.236 176.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.562 HD12 ' O ' ' A' ' 18' ' ' SER . 0.4 OUTLIER -136.68 155.41 49.91 Favored 'General case' 0 CA--C 1.562 1.428 0 C-N-CA 118.303 -1.359 . . . . 0.0 108.049 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.562 ' O ' HD12 ' A' ' 17' ' ' LEU . 15.8 m -83.67 163.78 20.08 Favored 'General case' 0 CA--C 1.568 1.645 0 CA-C-N 113.419 -1.719 . . . . 0.0 113.021 -177.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -164.71 172.7 12.73 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 111.074 -2.785 . . . . 0.0 107.457 173.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -132.65 151.64 51.9 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 104.621 -2.363 . . . . 0.0 104.621 178.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.5 ttp180 -46.89 104.48 0.05 Allowed 'General case' 0 CA--C 1.556 1.173 0 CA-C-N 112.994 -1.912 . . . . 0.0 112.381 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.32 -23.22 4.61 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-N 113.446 -1.706 . . . . 0.0 115.743 178.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.405 ' HB3' HD21 ' A' ' 41' ' ' LEU . 47.8 m-20 -48.57 147.65 2.4 Favored 'General case' 0 C--N 1.364 1.239 0 N-CA-C 116.274 1.953 . . . . 0.0 116.274 -177.055 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.2 mp -100.87 117.05 45.55 Favored 'Isoleucine or valine' 0 C--N 1.346 0.416 0 CA-C-N 111.772 -2.467 . . . . 0.0 104.922 176.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.693 HD22 HD13 ' A' ' 48' ' ' ILE . 4.6 mp -110.67 159.88 17.19 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 122.748 1.261 . . . . 0.0 112.707 -179.035 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.0 108.14 19.2 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-N 110.78 -2.918 . . . . 0.0 105.633 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.454 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 2.7 t -87.13 102.3 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 111.827 -3.949 . . . . 0.0 110.147 -174.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.9 tt . . . . . 0 CA--C 1.539 0.557 0 C-N-CA 117.4 -1.72 . . . . 0.0 106.904 -179.934 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.458 ' HA ' ' HG2' ' A' ' 50' ' ' LYS . 32.1 m-20 . . . . . 0 C--O 1.219 -0.55 0 CA-C-O 118.593 -0.718 . . . . 0.0 112.845 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -123.38 152.87 41.1 Favored 'General case' 0 CA--C 1.553 1.074 0 O-C-N 124.338 1.024 . . . . 0.0 109.389 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -134.21 144.64 48.57 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 104.992 -2.225 . . . . 0.0 104.992 177.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -101.18 124.7 47.29 Favored 'General case' 0 C--N 1.358 0.948 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 178.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -144.34 169.14 18.49 Favored 'General case' 0 C--N 1.357 0.911 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.205 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -109.6 136.16 49.42 Favored 'General case' 0 C--N 1.367 1.342 0 CA-C-N 113.79 -1.55 . . . . 0.0 111.338 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.533 ' HB2' HD11 ' A' ' 17' ' ' LEU 0.304 11.2 mt -162.49 139.76 8.12 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 110.297 -3.138 . . . . 0.0 113.577 177.575 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 58.39 28.94 17.52 Favored 'General case' 0 C--N 1.353 0.737 0 CA-C-N 110.829 -2.896 . . . . 0.0 115.48 169.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.07 18.19 78.87 Favored Glycine 0 CA--C 1.541 1.698 0 CA-C-N 114.647 -1.16 . . . . 0.0 114.199 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -137.37 166.56 23.52 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 124.593 1.157 . . . . 0.0 107.937 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -142.68 136.49 29.09 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 112.33 -2.214 . . . . 0.0 106.423 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.53 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -174.14 175.36 46.6 Favored Glycine 0 C--N 1.347 1.154 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.144 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -78.78 147.83 33.17 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 122.927 1.346 . . . . 0.0 110.25 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.693 HD13 HD22 ' A' ' 25' ' ' LEU . 9.0 pt -142.16 147.85 45.72 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-N 111.54 -2.573 . . . . 0.0 106.162 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -75.41 142.43 26.64 Favored 'Trans proline' 0 C--N 1.362 1.275 0 N-CA-C 114.498 0.922 . . . . 0.0 114.498 -177.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.458 ' HG2' ' HA ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -70.53 -30.92 67.79 Favored 'General case' 0 C--N 1.369 1.425 0 C-N-CA 113.345 -3.342 . . . . 0.0 113.493 -179.719 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -69.49 -9.54 54.2 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 116.161 -2.216 . . . . 0.0 114.726 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.43 ' CE1' HG22 ' B' ' 5' ' ' VAL . 7.5 m-85 -93.04 -12.0 31.67 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.346 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.608 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -128.62 171.66 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 178.359 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.482 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 85.5 tt0 -132.19 132.96 43.65 Favored 'General case' 0 C--N 1.355 0.817 0 CA-C-N 112.53 -2.123 . . . . 0.0 106.16 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.6 mpp? . . . . . 0 CA--C 1.537 0.467 0 CA-C-N 113.369 -1.741 . . . . 0.0 110.004 179.782 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 2' ' ' PRO . . . . . 0.431 ' HA ' ' HD3' ' B' ' 3' ' ' PRO . 2.8 Cg_endo . . . . . 0 N--CA 1.431 -2.156 0 N-CA-C 115.402 1.27 . . . . 0.0 115.402 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' B' ' 2' ' ' PRO . 38.5 Cg_exo -54.81 156.75 14.3 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.663 2.242 . . . . 0.0 117.03 179.065 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -69.54 123.45 10.18 Favored 'Trans proline' 0 C--N 1.365 1.407 0 N-CA-C 105.345 -2.598 . . . . 0.0 105.345 174.026 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.484 HG12 ' HD2' ' B' ' 6' ' ' PRO . 3.3 t -72.05 150.39 92.47 Favored Pre-proline 0 C--N 1.343 0.296 0 CA-C-N 113.619 -1.628 . . . . 0.0 108.665 -178.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 6' ' ' PRO . . . . . 0.484 ' HD2' HG12 ' B' ' 5' ' ' VAL . 19.5 Cg_exo -69.99 155.87 64.13 Favored 'Trans proline' 0 N--CA 1.445 -1.328 0 O-C-N 123.473 1.249 . . . . 0.0 112.297 176.238 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -72.52 118.29 5.52 Favored 'Trans proline' 0 CA--C 1.547 1.16 0 N-CA-C 107.253 -1.864 . . . . 0.0 107.253 175.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.351 0.659 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 178.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.897 ' HB1' HD11 ' A' ' 53' ' ' ILE . . . . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 122.459 1.123 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.428 12.0 mt -149.61 130.81 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 111.336 -2.665 . . . . 0.0 111.949 -167.461 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.467 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -65.84 126.3 28.08 Favored 'General case' 0 CA--C 1.556 1.174 0 CA-C-N 113.589 -1.641 . . . . 0.0 108.742 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mmpt? -98.02 -28.03 13.96 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 114.047 -1.433 . . . . 0.0 114.155 -178.476 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.412 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 22.1 m-85 -141.38 166.05 25.82 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 106.168 -1.79 . . . . 0.0 106.168 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.88 147.8 52.76 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 124.338 1.024 . . . . 0.0 109.451 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -146.69 132.78 19.28 Favored 'General case' 0 C--N 1.354 0.798 0 C-N-CA 118.043 -1.463 . . . . 0.0 109.471 176.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.9 mmtm -122.29 113.07 18.92 Favored 'General case' 0 C--N 1.346 0.431 0 CA-C-N 113.712 -1.585 . . . . 0.0 107.603 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.03 149.98 0.84 Allowed 'General case' 0 C--N 1.359 1.01 0 O-C-N 125.639 1.837 . . . . 0.0 112.468 -177.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.4 p -113.68 -19.4 11.59 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 111.054 -2.794 . . . . 0.0 113.557 -177.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.81 167.79 27.87 Favored 'General case' 0 C--N 1.354 0.777 0 CA-C-O 123.776 1.751 . . . . 0.0 111.965 -178.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -43.02 -39.67 2.75 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 109.824 -3.353 . . . . 0.0 115.393 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 49.2 p-10 -87.74 -0.81 57.41 Favored 'General case' 0 C--N 1.349 0.573 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 -175.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -106.39 159.77 15.89 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.714 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.626 HD11 ' HB2' ' A' ' 41' ' ' LEU . 0.5 OUTLIER -129.06 150.5 50.44 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 112.017 -2.356 . . . . 0.0 106.213 179.513 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.551 ' O ' HD12 ' A' ' 17' ' ' LEU . 10.2 m -84.07 169.1 15.26 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 123.709 1.718 . . . . 0.0 113.721 -177.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -162.69 178.99 8.02 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-N 111.712 -2.495 . . . . 0.0 108.377 171.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt -139.33 135.18 33.5 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 103.836 -2.653 . . . . 0.0 103.836 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -42.28 97.95 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.779 0 O-C-N 125.555 1.784 . . . . 0.0 113.489 -177.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.467 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 138.31 -22.81 3.04 Favored Glycine 0 C--N 1.35 1.344 0 CA-C-N 113.209 -1.814 . . . . 0.0 115.33 178.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.619 ' HB3' HD21 ' A' ' 41' ' ' LEU . 4.4 m-20 -47.02 143.3 3.08 Favored 'General case' 0 C--N 1.364 1.214 0 CA-C-O 121.547 0.689 . . . . 0.0 112.049 -179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mt -96.87 124.96 49.95 Favored 'Isoleucine or valine' 0 C--N 1.35 0.611 0 N-CA-C 103.498 -2.778 . . . . 0.0 103.498 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.485 HD22 ' CD1' ' A' ' 48' ' ' ILE . 0.8 OUTLIER -111.07 157.8 19.57 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 125.201 1.563 . . . . 0.0 111.711 -175.685 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -118.99 103.26 9.41 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 128.74 3.775 . . . . 0.0 108.605 176.041 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.5 t -85.19 103.33 12.17 Favored 'Isoleucine or valine' 0 C--N 1.353 0.759 0 C-N-CA 116.139 -2.224 . . . . 0.0 109.744 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 28' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--N 1.355 0.806 0 CA-C-N 112.826 -1.988 . . . . 0.0 105.89 177.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 . . . . . 0 N--CA 1.444 -0.729 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 55.6 m95 -135.85 164.01 28.91 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -178.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -137.47 145.9 43.63 Favored 'General case' 0 C--N 1.358 0.936 0 O-C-N 124.392 1.058 . . . . 0.0 109.198 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.73 115.23 30.08 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 176.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.75 172.12 13.24 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 118.936 -1.106 . . . . 0.0 112.225 -176.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -108.79 130.35 55.39 Favored 'General case' 0 C--N 1.357 0.902 0 CA-C-N 113.566 -1.652 . . . . 0.0 111.789 -178.119 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.626 ' HB2' HD11 ' A' ' 17' ' ' LEU 0.274 13.6 mt -163.15 146.29 10.57 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-N 110.409 -3.087 . . . . 0.0 115.501 178.131 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 57.35 29.03 16.19 Favored 'General case' 0 C--N 1.358 0.969 0 CA-C-N 111.374 -2.648 . . . . 0.0 114.929 169.299 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 71.83 21.15 79.03 Favored Glycine 0 CA--C 1.542 1.757 0 O-C-N 124.433 1.083 . . . . 0.0 114.679 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -138.16 169.59 17.52 Favored 'General case' 0 C--N 1.35 0.606 0 C-N-CA 125.532 1.533 . . . . 0.0 108.45 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -142.27 131.19 22.99 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 112.439 -2.164 . . . . 0.0 105.921 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.582 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -174.91 -179.22 45.35 Favored Glycine 0 C--N 1.344 1.023 0 C-N-CA 118.091 -2.004 . . . . 0.0 112.787 -178.419 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -78.17 145.04 35.86 Favored 'General case' 0 C--N 1.353 0.734 0 CA-C-N 113.445 -1.378 . . . . 0.0 111.475 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.485 ' CD1' HD22 ' A' ' 25' ' ' LEU . 27.0 pt -144.86 148.13 37.9 Favored Pre-proline 0 C--N 1.351 0.634 0 CA-C-N 112.362 -2.199 . . . . 0.0 108.465 178.269 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.44 ' HB3' ' HD2' ' B' ' 6' ' ' PRO . 11.6 Cg_endo -78.42 140.74 17.38 Favored 'Trans proline' 0 C--N 1.366 1.498 0 CA-C-N 119.472 0.847 . . . . 0.0 114.289 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.3 ptmm? -70.54 -35.57 73.2 Favored 'General case' 0 C--N 1.362 1.125 0 C-N-CA 116.344 -2.142 . . . . 0.0 113.106 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.268 0.7 OUTLIER -66.76 -9.86 41.2 Favored 'General case' 0 C--N 1.364 1.209 0 C-N-CA 114.276 -2.969 . . . . 0.0 114.57 -179.525 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -92.45 -12.6 31.66 Favored 'General case' 0 C--N 1.359 0.983 0 CA-C-O 117.446 -1.264 . . . . 0.0 111.589 178.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.897 HD11 ' HB1' ' A' ' 3' ' ' ALA . 0.0 OUTLIER -135.52 155.12 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 CA-C-N 119.07 0.85 . . . . 0.0 110.466 178.045 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.511 ' N ' HG12 ' A' ' 53' ' ' ILE . 40.8 tt0 -115.46 146.62 41.48 Favored 'General case' 0 C--N 1.361 1.069 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 177.701 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.346 0.438 0 CA-C-N 113.157 -1.838 . . . . 0.0 111.91 -178.002 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 2' ' ' PRO . . . . . 0.412 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 7.5 Cg_exo . . . . . 0 CA--C 1.551 1.331 0 CA-C-O 122.164 0.818 . . . . 0.0 114.155 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -54.18 158.71 8.92 Favored 'Trans proline' 0 C--N 1.358 1.07 0 N-CA-C 117.1 1.923 . . . . 0.0 117.1 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_endo -70.65 123.3 9.68 Favored 'Trans proline' 0 C--N 1.36 1.163 0 N-CA-C 104.91 -2.765 . . . . 0.0 104.91 173.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.507 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.3 t -63.81 148.39 94.72 Favored Pre-proline 0 C--N 1.35 0.625 0 O-C-N 124.84 1.338 . . . . 0.0 109.205 -178.022 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 6' ' ' PRO . . . . . 0.507 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 23.2 Cg_exo -62.61 153.48 71.46 Favored 'Trans proline' 0 N--CA 1.447 -1.221 0 O-C-N 122.93 0.963 . . . . 0.0 114.253 178.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -69.62 112.8 3.15 Favored 'Trans proline' 0 C--N 1.363 1.338 0 N-CA-C 106.648 -2.097 . . . . 0.0 106.648 176.115 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.343 0.303 0 CA-C-N 113.009 -1.905 . . . . 0.0 106.702 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.473 ' HB3' ' H ' ' A' ' 25' ' ' LEU . . . . . . . . 0 C--O 1.221 -0.398 0 CA-C-O 123.326 1.536 . . . . 0.0 113.881 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.454 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 2.0 mt -157.42 -177.3 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 100.425 -3.917 . . . . 0.0 100.425 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -165.82 108.87 0.79 Allowed 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 102.389 -3.189 . . . . 0.0 102.389 177.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.9 mtmp? -90.01 -15.19 32.39 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 111.122 -2.763 . . . . 0.0 116.504 -175.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.439 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 32.8 m-85 -142.35 164.79 29.19 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 179.151 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -71.37 152.88 42.75 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 117.17 -1.812 . . . . 0.0 108.419 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -142.68 142.69 32.08 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.5 tptt -134.83 103.79 5.75 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 112.548 -2.115 . . . . 0.0 108.164 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.25 158.6 0.1 Allowed 'General case' 0 N--CA 1.482 1.15 0 CA-C-O 122.944 1.354 . . . . 0.0 114.199 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.0 p -119.09 -15.28 9.26 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 110.335 -3.121 . . . . 0.0 112.669 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.16 170.08 21.4 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-O 123.316 1.531 . . . . 0.0 113.366 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -50.63 -34.79 27.56 Favored 'General case' 0 CA--C 1.555 1.159 0 CA-C-N 109.948 -3.296 . . . . 0.0 114.337 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -92.19 -5.0 53.38 Favored 'General case' 0 C--N 1.355 0.828 0 N-CA-C 115.551 1.686 . . . . 0.0 115.551 -176.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -108.86 156.5 19.59 Favored 'General case' 0 C--O 1.222 -0.377 0 O-C-N 124.826 1.329 . . . . 0.0 108.936 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.444 HD23 ' C ' ' A' ' 45' ' ' ASP 0.265 2.9 pp -137.79 156.04 48.38 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 112.718 -2.037 . . . . 0.0 111.121 177.831 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 m -84.42 170.54 13.45 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 111.913 -2.403 . . . . 0.0 115.484 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -163.53 175.56 10.58 Favored 'General case' 0 C--N 1.352 0.699 0 CA-C-N 109.461 -3.518 . . . . 0.0 107.586 175.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mtmt -136.53 143.18 43.58 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 112.777 -2.01 . . . . 0.0 106.388 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -44.08 98.05 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.28 0 O-C-N 126.247 2.217 . . . . 0.0 112.957 -178.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 140.34 -23.24 2.71 Favored Glycine 0 CA--C 1.543 1.81 0 CA-C-N 113.428 -1.714 . . . . 0.0 114.992 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -51.22 145.84 7.48 Favored 'General case' 0 C--N 1.363 1.154 0 N-CA-C 116.099 1.888 . . . . 0.0 116.099 -176.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -104.34 112.77 39.24 Favored 'Isoleucine or valine' 0 C--N 1.346 0.456 0 N-CA-C 102.188 -3.264 . . . . 0.0 102.188 173.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.565 HD22 HD13 ' A' ' 48' ' ' ILE . 6.3 mp -104.95 167.76 9.5 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 116.146 -2.222 . . . . 0.0 112.923 -176.182 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.72 109.15 20.97 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 176.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.402 HG23 ' HB2' ' A' ' 3' ' ' ALA . 71.1 t -87.78 97.02 6.19 Favored 'Isoleucine or valine' 0 C--N 1.357 0.927 0 C-N-CA 114.888 -2.725 . . . . 0.0 107.874 -177.21 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.446 -0.631 0 CA-C-N 111.955 -2.384 . . . . 0.0 107.484 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 27.3 m-20 . . . . . 0 CA--C 1.566 1.589 0 CA-C-O 119.22 -0.419 . . . . 0.0 109.913 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.5 m95 -136.49 161.31 36.21 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.776 0.798 . . . . 0.0 110.85 -177.381 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -133.71 150.92 51.52 Favored 'General case' 0 C--N 1.355 0.819 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.7 tttt -102.68 119.16 38.35 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 176.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.0 170.11 16.34 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 118.273 -1.371 . . . . 0.0 113.401 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -110.57 138.55 46.82 Favored 'General case' 0 C--N 1.362 1.116 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.64 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.507 HD11 HD21 ' A' ' 25' ' ' LEU 0.281 12.1 mt -160.02 138.24 10.19 Favored 'General case' 0 CA--C 1.502 -0.88 0 CA-C-N 112.709 -2.041 . . . . 0.0 112.977 179.131 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 56.92 21.9 6.62 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 116.191 -2.203 . . . . 0.0 115.658 168.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 92.51 -9.06 76.58 Favored Glycine 0 CA--C 1.546 1.988 0 N-CA-C 115.37 0.908 . . . . 0.0 115.37 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.9 mttp -113.25 170.05 8.5 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.444 ' C ' HD23 ' A' ' 17' ' ' LEU . 19.9 t70 -140.94 131.17 24.92 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 113.119 -1.855 . . . . 0.0 106.303 -179.06 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.96 173.37 45.57 Favored Glycine 0 C--N 1.349 1.267 0 C-N-CA 116.401 -2.809 . . . . 0.0 113.217 -177.507 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -76.77 139.34 40.37 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 123.653 1.692 . . . . 0.0 109.511 -179.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.565 HD13 HD22 ' A' ' 25' ' ' LEU . 1.0 OUTLIER -139.99 143.1 32.93 Favored Pre-proline 0 C--N 1.347 0.498 0 CA-C-N 110.8 -2.909 . . . . 0.0 106.462 179.471 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -74.76 143.75 30.31 Favored 'Trans proline' 0 C--N 1.361 1.216 0 N-CA-C 115.07 1.142 . . . . 0.0 115.07 -175.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 15.6 pttt -71.9 -33.85 68.65 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 116.072 -2.251 . . . . 0.0 113.947 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -62.11 -19.66 63.23 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-N 115.077 -0.965 . . . . 0.0 113.144 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -93.35 -13.34 28.22 Favored 'General case' 0 CA--C 1.566 1.591 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.502 HG21 ' CD1' ' A' ' 48' ' ' ILE . 0.1 OUTLIER -126.86 173.25 12.79 Favored 'Isoleucine or valine' 0 C--N 1.368 1.401 0 CA-C-O 121.808 0.813 . . . . 0.0 111.115 -178.338 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.494 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 0.2 OUTLIER -131.41 137.15 48.55 Favored 'General case' 0 C--N 1.358 0.971 0 CA-C-N 112.691 -2.05 . . . . 0.0 107.494 178.163 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 62.2 mtm . . . . . 0 C--N 1.343 0.301 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.239 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 2' ' ' PRO . . . . . 0.439 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 5.0 Cg_exo . . . . . 0 CA--C 1.573 2.431 0 N-CA-C 116.069 1.527 . . . . 0.0 116.069 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -52.6 156.35 8.87 Favored 'Trans proline' 0 C--N 1.373 1.831 0 C-N-CA 123.953 3.102 . . . . 0.0 116.785 178.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -74.67 120.34 6.12 Favored 'Trans proline' 0 C--N 1.358 1.037 0 N-CA-C 106.287 -2.236 . . . . 0.0 106.287 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.477 HG12 ' HD2' ' B' ' 6' ' ' PRO . 2.5 t -66.02 149.95 97.14 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-N 113.555 -1.657 . . . . 0.0 109.908 -178.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 6' ' ' PRO . . . . . 0.477 ' HD2' HG12 ' B' ' 5' ' ' VAL . 15.7 Cg_exo -71.26 159.95 50.35 Favored 'Trans proline' 0 C--N 1.359 1.099 0 N-CA-C 116.749 1.788 . . . . 0.0 116.749 178.671 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -75.94 118.69 5.11 Favored 'Trans proline' 0 C--N 1.359 1.098 0 N-CA-C 107.157 -1.901 . . . . 0.0 107.157 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.497 ' H ' ' NE ' ' B' ' 8' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.345 0.378 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 178.22 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.638 ' HB1' ' CD1' ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.445 -0.716 0 CA-C-O 122.361 1.077 . . . . 0.0 109.648 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.452 ' H ' HG13 ' A' ' 53' ' ' ILE . 11.1 mt -156.63 110.02 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.806 0 CA-C-N 111.286 -2.688 . . . . 0.0 109.408 -176.576 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.573 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -68.17 122.13 17.64 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 116.073 -2.251 . . . . 0.0 109.375 178.811 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -96.16 -23.01 16.94 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -179.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.553 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 17.6 m-85 -140.01 160.57 39.64 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.2 151.22 47.93 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.042 -1.435 . . . . 0.0 109.561 -178.263 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -143.77 139.3 29.33 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 176.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? -126.45 96.88 4.83 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-N 111.964 -2.38 . . . . 0.0 109.677 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -45.22 149.51 0.5 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 122.192 0.996 . . . . 0.0 113.387 -178.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.8 t -123.92 2.32 8.72 Favored 'General case' 0 C--N 1.354 0.772 0 CA-C-N 111.309 -2.678 . . . . 0.0 114.855 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.4 163.84 39.21 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 118.399 -1.32 . . . . 0.0 110.363 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -50.6 -39.17 49.23 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-N 111.609 -2.541 . . . . 0.0 113.264 -178.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.6 p30 -88.9 1.07 55.97 Favored 'General case' 0 C--N 1.354 0.778 0 N-CA-C 116.421 2.008 . . . . 0.0 116.421 -176.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -113.66 153.14 29.42 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 124.633 1.208 . . . . 0.0 109.382 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.627 HD23 ' N ' ' A' ' 46' ' ' GLY . 0.6 OUTLIER -136.39 158.76 43.66 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 113.47 -1.695 . . . . 0.0 110.793 178.476 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.531 ' O ' HD12 ' A' ' 17' ' ' LEU . 15.7 m -84.2 170.83 13.36 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 116.933 2.197 . . . . 0.0 116.933 -177.41 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -163.83 170.55 16.7 Favored 'General case' 0 C--N 1.355 0.824 0 CA-C-N 109.07 -3.695 . . . . 0.0 109.863 176.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -135.45 118.29 16.2 Favored 'General case' 0 C--N 1.354 0.787 0 CA-C-N 112.57 -2.105 . . . . 0.0 110.57 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -14.51 74.48 0.0 OUTLIER 'General case' 0 CA--C 1.559 1.291 0 N-CA-C 116.837 2.162 . . . . 0.0 116.837 178.149 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.573 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 150.78 -16.74 0.94 Allowed Glycine 0 CA--C 1.537 1.427 0 CA-C-N 111.847 -2.433 . . . . 0.0 116.0 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.587 ' HB3' HD21 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -50.96 151.59 2.5 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -178.531 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.3 pt -98.71 108.68 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.393 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.621 HD22 HD13 ' A' ' 48' ' ' ILE . 3.0 mp -104.75 157.36 17.25 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 116.443 -2.103 . . . . 0.0 110.804 -177.287 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -105.0 106.54 17.07 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 110.922 -2.854 . . . . 0.0 108.026 177.399 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 86.6 t -86.7 111.08 21.01 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 C-N-CA 115.216 -2.594 . . . . 0.0 106.099 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.742 ' O ' HD13 ' A' ' 28' ' ' LEU . 3.4 tm? . . . . . 0 C--N 1.352 0.708 0 CA-C-N 112.592 -2.095 . . . . 0.0 113.844 -176.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.406 ' HA ' ' CD ' ' A' ' 50' ' ' LYS . 22.3 m-20 . . . . . 0 CA--C 1.562 1.441 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.565 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -135.39 169.58 17.27 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 122.357 1.075 . . . . 0.0 109.66 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -137.97 139.62 39.8 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 113.235 -1.802 . . . . 0.0 106.715 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -98.76 115.52 28.94 Favored 'General case' 0 C--N 1.354 0.772 0 N-CA-C 100.393 -3.928 . . . . 0.0 100.393 176.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.49 176.23 8.89 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 125.044 1.465 . . . . 0.0 113.417 -173.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -120.02 148.32 43.71 Favored 'General case' 0 C--N 1.362 1.12 0 O-C-N 125.064 1.478 . . . . 0.0 111.118 -179.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.587 HD21 ' HB3' ' A' ' 23' ' ' ASP 0.302 9.4 mt -161.94 138.93 8.33 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-N 110.465 -3.061 . . . . 0.0 111.953 179.342 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.63 29.06 12.92 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 115.688 -2.405 . . . . 0.0 116.43 168.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.94 10.63 85.42 Favored Glycine 0 CA--C 1.546 2.019 0 C-N-CA 118.662 -1.732 . . . . 0.0 115.013 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -135.73 163.01 31.15 Favored 'General case' 0 C--O 1.217 -0.629 0 C-N-CA 124.597 1.159 . . . . 0.0 107.942 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -141.41 139.73 33.51 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.419 -178.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.627 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -170.96 176.09 44.46 Favored Glycine 0 C--N 1.347 1.161 0 C-N-CA 118.477 -1.82 . . . . 0.0 110.591 -177.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -77.3 144.8 37.83 Favored 'General case' 0 C--N 1.354 0.801 0 CA-C-O 122.522 1.153 . . . . 0.0 110.708 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.621 HD13 HD22 ' A' ' 25' ' ' LEU . 1.3 pt -144.42 139.29 15.48 Favored Pre-proline 0 C--N 1.352 0.677 0 CA-C-N 112.392 -2.185 . . . . 0.0 107.819 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -72.02 148.66 51.38 Favored 'Trans proline' 0 C--N 1.363 1.336 0 CA-C-N 120.018 1.042 . . . . 0.0 114.197 -176.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.406 ' CD ' ' HA ' ' A' ' 35' ' ' ASN . 18.6 ptmt -70.22 -41.69 73.29 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 115.136 -2.626 . . . . 0.0 111.395 -178.422 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.405 HD22 ' HB2' ' B' ' 3' ' ' PRO . 13.1 p-10 -57.46 -18.68 19.65 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.421 ' CE1' HG22 ' B' ' 5' ' ' VAL . 6.9 m-85 -91.63 -7.81 48.98 Favored 'General case' 0 C--N 1.355 0.843 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.191 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.638 ' CD1' ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -129.83 172.8 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.1 0 CA-C-O 122.184 0.992 . . . . 0.0 108.759 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.438 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 21.7 tt0 -129.47 131.74 46.76 Favored 'General case' 0 C--N 1.349 0.568 0 N-CA-C 104.756 -2.312 . . . . 0.0 104.756 176.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.5 mpp? . . . . . 0 CA--C 1.518 -0.268 0 CA-C-N 113.556 -1.656 . . . . 0.0 110.599 178.027 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 2' ' ' PRO . . . . . 0.553 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 2.7 Cg_endo . . . . . 0 CA--C 1.579 2.73 0 N-CA-C 116.01 1.504 . . . . 0.0 116.01 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' B' ' 2' ' ' PRO . 36.0 Cg_exo -58.7 161.07 15.79 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 123.594 2.863 . . . . 0.0 118.297 179.051 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -71.45 117.92 5.4 Favored 'Trans proline' 0 C--N 1.37 1.69 0 N-CA-C 105.498 -2.539 . . . . 0.0 105.498 174.383 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.435 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.1 t -65.56 147.34 98.73 Favored Pre-proline 0 CA--C 1.551 0.997 0 CA-C-N 113.685 -1.598 . . . . 0.0 109.135 -178.194 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 6' ' ' PRO . . . . . 0.435 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 2.8 Cg_exo -68.1 159.64 52.19 Favored 'Trans proline' 0 C--N 1.363 1.329 0 N-CA-C 116.805 1.81 . . . . 0.0 116.805 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -76.28 119.81 5.42 Favored 'Trans proline' 0 CA--C 1.553 1.443 0 N-CA-C 107.785 -1.659 . . . . 0.0 107.785 175.54 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.362 1.118 0 C-N-CA 118.495 -1.282 . . . . 0.0 109.879 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.803 ' HB1' HD11 ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.448 -0.563 0 N-CA-C 105.139 -2.171 . . . . 0.0 105.139 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.7 mt -146.67 112.75 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 N-CA-C 104.924 -2.251 . . . . 0.0 104.924 -174.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.21 144.2 55.02 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-N 112.033 -2.349 . . . . 0.0 110.715 -178.226 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 mtmt -98.95 -28.04 13.61 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 128.21 2.604 . . . . 0.0 113.205 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.507 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 58.8 m-85 -144.63 164.21 31.63 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 117.521 -1.672 . . . . 0.0 108.463 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -64.53 143.57 57.82 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 113.398 -1.728 . . . . 0.0 107.876 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -142.46 142.67 32.35 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 122.857 1.313 . . . . 0.0 107.902 177.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.25 115.55 16.47 Favored 'General case' 0 CA--C 1.56 1.332 0 CA-C-N 111.632 -2.531 . . . . 0.0 109.687 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.35 147.93 2.13 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.372 0.606 . . . . 0.0 112.435 -177.803 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.7 p -121.96 -5.52 9.03 Favored 'General case' 0 C--N 1.353 0.74 0 CA-C-N 113.449 -1.705 . . . . 0.0 112.602 -178.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.55 165.34 34.55 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-O 123.34 1.543 . . . . 0.0 110.287 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -50.67 -35.99 33.57 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 110.28 -3.145 . . . . 0.0 115.453 -178.001 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 52.4 p-10 -93.23 0.9 57.22 Favored 'General case' 0 C--N 1.352 0.684 0 O-C-N 124.444 1.09 . . . . 0.0 113.811 -176.311 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -109.81 160.81 16.03 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 114.152 -1.385 . . . . 0.0 109.71 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.765 HD11 ' HB2' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -135.8 161.09 36.56 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-N 113.754 -1.566 . . . . 0.0 110.109 179.813 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.531 ' O ' HD12 ' A' ' 17' ' ' LEU . 3.0 m -84.87 163.74 18.83 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 113.676 -1.602 . . . . 0.0 115.186 -179.158 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 50.9 p90 -164.41 160.46 20.7 Favored 'General case' 0 C--N 1.359 0.991 0 CA-C-N 110.85 -2.886 . . . . 0.0 109.788 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.36 119.36 16.42 Favored 'General case' 0 C--N 1.348 0.542 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.671 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -4.04 92.58 0.01 OUTLIER 'General case' 0 C--N 1.363 1.154 0 C-N-CA 127.185 2.194 . . . . 0.0 114.23 -178.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 118.29 8.03 10.68 Favored Glycine 0 C--N 1.353 1.485 0 O-C-N 125.014 1.446 . . . . 0.0 116.252 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.566 ' HB3' HD21 ' A' ' 41' ' ' LEU . 59.5 m-20 -62.28 152.95 32.15 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 117.372 -1.731 . . . . 0.0 112.936 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 83.6 mt -96.16 112.22 27.94 Favored 'Isoleucine or valine' 0 C--N 1.352 0.702 0 N-CA-C 104.895 -2.261 . . . . 0.0 104.895 178.149 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.809 HD11 HD11 ' A' ' 41' ' ' LEU . 0.3 OUTLIER -103.93 145.79 29.62 Favored 'General case' 0 C--N 1.352 0.706 0 CA-C-N 113.302 -1.772 . . . . 0.0 111.037 -176.027 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.12 113.03 24.15 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-N 111.714 -2.494 . . . . 0.0 108.429 177.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 t -86.35 108.03 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 115.106 -2.638 . . . . 0.0 111.404 -174.111 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.434 ' HA ' HD12 ' A' ' 28' ' ' LEU . 12.4 tp . . . . . 0 C--N 1.351 0.641 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 -178.358 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 . . . . . 0 CA--C 1.548 0.882 0 CA-C-O 119.42 -0.324 . . . . 0.0 111.624 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.7 m95 -139.0 154.84 48.3 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-O 121.316 0.579 . . . . 0.0 110.373 -177.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -136.15 137.57 41.09 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 104.728 -2.323 . . . . 0.0 104.728 175.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -98.78 117.48 33.35 Favored 'General case' 0 C--N 1.353 0.723 0 N-CA-C 105.212 -2.144 . . . . 0.0 105.212 176.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.38 174.95 10.0 Favored 'General case' 0 C--N 1.352 0.68 0 O-C-N 124.346 1.029 . . . . 0.0 111.793 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.5 132.15 52.85 Favored 'General case' 0 C--N 1.359 1.018 0 O-C-N 124.482 1.114 . . . . 0.0 110.23 -178.292 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.809 HD11 HD11 ' A' ' 25' ' ' LEU 0.257 9.8 mt -159.84 145.8 15.77 Favored 'General case' 0 C--N 1.36 1.025 0 CA-C-N 111.482 -2.599 . . . . 0.0 114.736 178.739 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.26 28.27 13.03 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 110.723 -2.944 . . . . 0.0 115.011 170.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.9 11.54 82.53 Favored Glycine 0 CA--C 1.541 1.688 0 C-N-CA 119.612 -1.28 . . . . 0.0 114.509 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -138.51 -177.89 5.05 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-O 122.566 1.174 . . . . 0.0 110.225 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -141.93 133.07 26.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 112.232 -2.258 . . . . 0.0 105.556 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.427 ' CA ' HD23 ' A' ' 17' ' ' LEU . . . -173.05 173.65 45.68 Favored Glycine 0 C--N 1.338 0.688 0 C-N-CA 117.437 -2.316 . . . . 0.0 111.834 -178.202 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -77.73 146.61 35.83 Favored 'General case' 0 CA--C 1.56 1.356 0 CA-C-N 112.54 -1.83 . . . . 0.0 110.665 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.9 pt -143.79 144.75 28.16 Favored Pre-proline 0 C--N 1.352 0.711 0 CA-C-N 111.414 -2.63 . . . . 0.0 107.475 177.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -80.18 138.61 12.81 Favored 'Trans proline' 0 C--N 1.367 1.534 0 N-CA-C 114.808 1.042 . . . . 0.0 114.808 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.52 -35.06 70.58 Favored 'General case' 0 C--N 1.354 0.768 0 CA-C-O 117.009 -1.472 . . . . 0.0 113.009 -178.44 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.277 0.5 OUTLIER -63.03 -10.71 15.06 Favored 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 113.046 -3.462 . . . . 0.0 112.834 178.146 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -94.67 -15.08 24.25 Favored 'General case' 0 CA--C 1.555 1.159 0 CA-C-O 117.47 -1.253 . . . . 0.0 108.942 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.803 HD11 ' HB1' ' A' ' 3' ' ' ALA . 0.0 OUTLIER -133.98 160.56 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-O 122.901 1.334 . . . . 0.0 111.111 178.481 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.449 ' H ' HG12 ' A' ' 53' ' ' ILE . 18.3 tt0 -126.9 145.01 50.83 Favored 'General case' 0 C--N 1.346 0.424 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 178.048 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.343 0.324 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.261 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 2' ' ' PRO . . . . . 0.507 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 3.2 Cg_exo . . . . . 0 CA--C 1.571 2.331 0 N-CA-C 116.494 1.69 . . . . 0.0 116.494 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -50.6 160.18 1.83 Allowed 'Trans proline' 0 C--N 1.372 1.816 0 C-N-CA 124.499 3.466 . . . . 0.0 118.74 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -75.69 112.77 3.59 Favored 'Trans proline' 0 C--N 1.357 1.02 0 N-CA-C 106.621 -2.107 . . . . 0.0 106.621 176.071 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 3.5 t -58.26 143.61 79.08 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 113.256 -1.793 . . . . 0.0 109.824 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -61.2 150.31 85.16 Favored 'Trans proline' 0 C--N 1.359 1.117 0 O-C-N 122.789 0.889 . . . . 0.0 114.067 179.066 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_endo -67.68 111.78 2.46 Favored 'Trans proline' 0 C--N 1.364 1.391 0 N-CA-C 107.713 -1.687 . . . . 0.0 107.713 177.064 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.353 0.761 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 -178.682 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.692 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.453 -0.276 0 CA-C-O 121.902 0.858 . . . . 0.0 109.132 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.1 mt -145.01 117.42 2.34 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 CA-C-N 112.647 -2.07 . . . . 0.0 109.762 -176.682 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.43 125.22 26.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 117.296 -1.762 . . . . 0.0 108.311 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.9 -24.95 16.18 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.521 -1.218 . . . . 0.0 114.139 -178.349 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.588 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 41.6 m-85 -142.49 165.65 26.83 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -68.84 157.97 35.42 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 116.69 -2.004 . . . . 0.0 109.173 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.488 ' HE1' HG21 ' B' ' 5' ' ' VAL . 12.6 t80 -145.96 142.78 29.02 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 118.554 -1.258 . . . . 0.0 108.895 175.366 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -129.44 100.96 5.75 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 127.333 2.253 . . . . 0.0 108.993 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.93 160.26 0.04 OUTLIER 'General case' 0 C--N 1.352 0.696 0 CA-C-O 123.079 1.419 . . . . 0.0 113.862 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 p -117.12 -25.63 7.08 Favored 'General case' 0 CA--C 1.557 1.247 0 CA-C-N 110.648 -2.978 . . . . 0.0 112.348 -178.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.73 168.15 26.63 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 117.096 -1.842 . . . . 0.0 110.628 -177.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -42.54 -40.58 2.7 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 109.949 -3.296 . . . . 0.0 114.352 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -85.83 0.86 51.87 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -177.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -112.13 155.84 23.26 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 178.679 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.553 HD12 ' C ' ' A' ' 17' ' ' LEU . 1.4 pp -136.63 155.58 49.71 Favored 'General case' 0 C--N 1.345 0.411 0 CA-C-N 113.371 -1.74 . . . . 0.0 108.422 178.463 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.0 m -87.15 173.17 9.41 Favored 'General case' 0 CA--C 1.47 -2.125 0 N-CA-C 119.274 3.065 . . . . 0.0 119.274 -177.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -162.88 -175.6 4.48 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 108.532 -3.94 . . . . 0.0 108.625 175.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.73 140.58 34.88 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 112.328 -2.214 . . . . 0.0 105.95 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.81 101.57 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.875 0 O-C-N 124.974 1.421 . . . . 0.0 111.63 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 136.3 -25.04 3.19 Favored Glycine 0 C--N 1.355 1.59 0 CA-C-N 113.96 -1.473 . . . . 0.0 114.232 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -58.38 145.86 36.81 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 117.036 -1.865 . . . . 0.0 112.8 -177.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.2 mm -97.58 113.95 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 103.398 -2.815 . . . . 0.0 103.398 178.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.612 ' CD1' HD11 ' A' ' 41' ' ' LEU . 1.4 mm? -100.96 162.78 12.65 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 116.241 -2.184 . . . . 0.0 109.697 -175.463 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -103.31 111.07 23.31 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 108.949 -3.751 . . . . 0.0 105.903 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.674 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 90.1 t -87.83 100.34 10.07 Favored 'Isoleucine or valine' 0 C--N 1.342 0.275 0 C-N-CA 116.391 -2.124 . . . . 0.0 111.259 -175.018 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 tm? . . . . . 0 C--N 1.349 0.579 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 177.484 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.6 m-20 . . . . . 0 CA--C 1.553 1.074 0 CA-C-O 118.275 -0.869 . . . . 0.0 113.004 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -136.39 161.01 37.02 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.997 0.903 . . . . 0.0 109.517 -177.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -131.91 145.1 51.31 Favored 'General case' 0 C--N 1.345 0.381 0 CA-C-N 112.926 -1.943 . . . . 0.0 106.4 178.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 38.8 tttm -101.65 121.27 41.71 Favored 'General case' 0 C--N 1.348 0.523 0 N-CA-C 105.852 -1.906 . . . . 0.0 105.852 177.285 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -142.29 176.4 9.02 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 118.719 -1.192 . . . . 0.0 113.464 -176.577 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -120.73 140.18 52.02 Favored 'General case' 0 C--O 1.203 -1.362 0 CA-C-O 123.608 1.67 . . . . 0.0 111.879 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.612 HD11 ' CD1' ' A' ' 25' ' ' LEU 0.29 16.1 mt -162.14 154.66 19.65 Favored 'General case' 0 C--O 1.189 -2.109 0 CA-C-N 110.033 -3.258 . . . . 0.0 114.005 178.055 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 48.69 23.4 0.64 Allowed 'General case' 0 CA--C 1.555 1.163 0 O-C-N 127.163 2.79 . . . . 0.0 116.237 169.58 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.94 -5.43 85.13 Favored Glycine 0 CA--C 1.559 2.825 0 N-CA-C 116.439 1.336 . . . . 0.0 116.439 -178.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.9 mtmt -118.57 173.43 6.85 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 123.163 1.459 . . . . 0.0 107.811 177.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.548 ' C ' HD23 ' A' ' 17' ' ' LEU . 35.0 p-10 -142.6 133.31 25.37 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 111.7 -2.5 . . . . 0.0 106.8 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.42 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -169.36 178.03 42.69 Favored Glycine 0 C--N 1.346 1.124 0 C-N-CA 117.091 -2.48 . . . . 0.0 111.344 -178.434 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -77.46 146.96 36.16 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 118.62 -1.232 . . . . 0.0 112.684 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 21.1 pt -142.29 137.74 15.93 Favored Pre-proline 0 C--N 1.359 0.999 0 CA-C-N 112.62 -2.082 . . . . 0.0 107.506 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -70.38 147.89 59.88 Favored 'Trans proline' 0 C--N 1.356 0.955 0 N-CA-C 114.339 0.861 . . . . 0.0 114.339 -176.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -71.11 -43.29 67.94 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 116.597 -2.041 . . . . 0.0 111.371 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.418 HD22 ' HB2' ' B' ' 3' ' ' PRO . 8.0 p-10 -53.91 -23.99 14.63 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 178.743 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' TYR . . . . . 0.618 ' CE1' HG22 ' B' ' 5' ' ' VAL . 6.4 m-85 -89.54 -3.23 58.42 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 118.986 -1.086 . . . . 0.0 111.518 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.692 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -129.54 173.61 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.142 0 CA-C-N 119.64 1.109 . . . . 0.0 108.909 178.775 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.413 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 31.3 tt0 -129.81 121.03 25.98 Favored 'General case' 0 C--N 1.347 0.49 0 N-CA-C 103.487 -2.783 . . . . 0.0 103.487 178.148 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.345 0.373 0 CA-C-N 113.143 -1.844 . . . . 0.0 112.143 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 2' ' ' PRO . . . . . 0.588 ' HB3' ' CD2' ' A' ' 7' ' ' TYR 0.258 3.4 Cg_exo . . . . . 0 N--CA 1.431 -2.195 0 N-CA-C 115.186 1.187 . . . . 0.0 115.186 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.418 ' HB2' HD22 ' A' ' 51' ' ' ASN . 51.5 Cg_exo -45.91 155.52 0.56 Allowed 'Trans proline' 0 C--N 1.368 1.586 0 C-N-CA 123.127 2.551 . . . . 0.0 116.518 -179.436 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -76.0 105.82 2.15 Favored 'Trans proline' 0 C--N 1.366 1.484 0 N-CA-C 106.256 -2.248 . . . . 0.0 106.256 178.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.618 HG22 ' CE1' ' A' ' 52' ' ' TYR . 4.2 t -50.36 146.13 9.37 Favored Pre-proline 0 CA--C 1.559 1.314 0 CA-C-N 113.492 -1.686 . . . . 0.0 110.639 -178.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.69 155.66 69.4 Favored 'Trans proline' 0 C--N 1.365 1.44 0 C-N-CA 120.937 1.091 . . . . 0.0 113.854 178.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -73.37 110.29 3.03 Favored 'Trans proline' 0 C--N 1.356 0.928 0 N-CA-C 106.164 -2.283 . . . . 0.0 106.164 176.492 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.505 0 C-N-CA 116.747 -1.981 . . . . 0.0 106.247 -179.448 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.759 ' HB2' HG13 ' A' ' 27' ' ' VAL . . . . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.2 mt -150.19 122.6 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.352 0.706 0 CA-C-N 113.239 -1.8 . . . . 0.0 109.784 -175.809 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.517 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -67.04 127.57 33.07 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 113.31 -1.768 . . . . 0.0 110.788 178.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.12 -24.14 18.37 Favored 'General case' 0 CA--C 1.558 1.274 0 CA-C-N 113.887 -1.506 . . . . 0.0 112.577 178.649 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -141.34 166.5 24.6 Favored 'General case' 0 C--N 1.355 0.836 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.019 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -68.86 156.21 38.84 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 116.689 -2.004 . . . . 0.0 108.176 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -146.24 138.82 25.39 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 174.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.407 ' O ' ' CD ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -129.39 103.24 6.8 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 106.506 -1.664 . . . . 0.0 106.506 177.266 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.96 157.62 0.15 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 122.954 1.359 . . . . 0.0 112.236 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -148.29 20.82 1.08 Allowed 'General case' 0 CA--C 1.565 1.548 0 CA-C-N 111.073 -2.785 . . . . 0.0 114.19 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.84 140.7 20.11 Favored 'General case' 0 C--N 1.348 0.527 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -43.08 -32.85 0.75 Allowed 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 114.131 -1.395 . . . . 0.0 114.048 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 53.8 p30 -92.54 -4.59 53.26 Favored 'General case' 0 CA--C 1.568 1.663 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 -178.506 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -107.34 154.74 20.84 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.89 0.852 . . . . 0.0 108.849 -178.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 pp -133.3 158.72 42.24 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 112.481 -2.145 . . . . 0.0 111.161 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.7 m -85.75 171.63 11.45 Favored 'General case' 0 C--N 1.35 0.601 0 N-CA-C 117.191 2.293 . . . . 0.0 117.191 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.4 p90 -164.36 166.53 20.67 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 109.827 -3.352 . . . . 0.0 109.115 174.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -134.96 111.72 10.05 Favored 'General case' 0 CA--C 1.557 1.236 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.367 178.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -3.88 93.23 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 127.516 2.326 . . . . 0.0 113.962 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.517 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 120.38 3.7 11.4 Favored Glycine 0 CA--C 1.547 2.034 0 CA-C-N 113.688 -1.596 . . . . 0.0 116.495 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . 0.523 ' HB3' HD21 ' A' ' 41' ' ' LEU . 59.8 m-20 -59.12 155.45 13.89 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-O 122.58 1.181 . . . . 0.0 113.196 -178.074 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 pt -96.93 103.92 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.319 0 CA-C-N 111.16 -2.745 . . . . 0.0 104.851 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.606 HD21 HD11 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -108.05 158.95 16.95 Favored 'General case' 0 C--N 1.349 0.587 0 CA-C-N 113.804 -1.543 . . . . 0.0 110.812 -176.181 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.73 109.64 14.49 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 112.295 -2.23 . . . . 0.0 107.192 177.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.759 HG13 ' HB2' ' A' ' 3' ' ' ALA . 1.8 m -85.88 114.98 26.49 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 C-N-CA 117.099 -1.84 . . . . 0.0 110.24 -176.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.585 HD13 ' O ' ' A' ' 28' ' ' LEU . 1.3 tm? . . . . . 0 CA--C 1.544 0.716 0 CA-C-N 111.828 -2.442 . . . . 0.0 117.015 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.2 m120 . . . . . 0 CA--C 1.55 0.95 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -139.96 168.47 19.73 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 121.535 0.684 . . . . 0.0 109.406 -176.909 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -140.87 150.1 42.8 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.396 -1.274 . . . . 0.0 107.841 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -103.99 117.95 35.51 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 105.397 -2.075 . . . . 0.0 105.397 176.171 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -140.5 176.62 8.63 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 123.982 0.801 . . . . 0.0 112.399 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -112.03 135.75 52.28 Favored 'General case' 0 C--N 1.364 1.21 0 O-C-N 123.89 0.743 . . . . 0.0 109.728 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.606 HD11 HD21 ' A' ' 25' ' ' LEU . 18.5 mt -160.36 143.67 13.64 Favored 'General case' 0 CA--C 1.468 -2.181 0 C-N-CA 126.864 2.066 . . . . 0.0 115.685 -178.934 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.25 32.31 18.33 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 115.358 -2.537 . . . . 0.0 115.967 168.437 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.1 -4.92 68.61 Favored Glycine 0 CA--C 1.558 2.774 0 C-N-CA 119.891 -1.147 . . . . 0.0 115.696 -178.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.0 -175.68 3.29 Favored 'General case' 0 C--N 1.352 0.705 0 CA-C-O 122.983 1.373 . . . . 0.0 109.505 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -142.48 134.25 26.9 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 111.61 -2.541 . . . . 0.0 104.789 178.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.45 175.5 45.59 Favored Glycine 0 C--N 1.35 1.317 0 C-N-CA 116.373 -2.822 . . . . 0.0 112.215 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -77.49 143.67 38.31 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 117.927 -1.509 . . . . 0.0 112.014 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.711 HD12 HG21 ' A' ' 53' ' ' ILE . 3.8 pt -142.57 144.59 30.98 Favored Pre-proline 0 C--N 1.356 0.865 0 CA-C-N 112.064 -2.335 . . . . 0.0 107.817 179.121 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -77.79 155.38 30.79 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 N-CA-C 118.471 2.451 . . . . 0.0 118.471 -177.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.7 mttt -68.61 -56.5 8.03 Favored 'General case' 0 C--N 1.36 1.042 0 CA-C-N 112.651 -2.068 . . . . 0.0 110.261 178.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.321 0.7 OUTLIER -59.19 -8.34 1.55 Allowed 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 115.28 -2.568 . . . . 0.0 115.683 -179.752 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -95.07 -11.54 28.13 Favored 'General case' 0 CA--C 1.567 1.622 0 CA-C-O 117.642 -1.17 . . . . 0.0 113.55 175.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.711 HG21 HD12 ' A' ' 48' ' ' ILE . 0.1 OUTLIER -133.15 166.56 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 CA-C-N 120.368 1.44 . . . . 0.0 110.159 -178.915 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.404 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 8.3 tt0 -127.71 136.02 50.97 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 112.543 -2.117 . . . . 0.0 105.583 175.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.434 ' CE ' HG11 ' A' ' 27' ' ' VAL . 5.5 mtp . . . . . 0 CA--C 1.538 0.493 0 CA-C-N 114.04 -1.436 . . . . 0.0 108.885 179.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo . . . . . 0 N--CA 1.443 -1.47 0 N-CA-C 117.063 1.909 . . . . 0.0 117.063 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -50.58 159.13 2.33 Favored 'Trans proline' 0 C--N 1.369 1.614 0 C-N-CA 122.07 1.847 . . . . 0.0 115.141 177.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -71.07 119.47 6.33 Favored 'Trans proline' 0 C--N 1.363 1.328 0 N-CA-C 104.394 -2.964 . . . . 0.0 104.394 176.08 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.418 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 5.4 t -62.85 148.85 91.12 Favored Pre-proline 0 CA--C 1.545 0.771 0 O-C-N 124.59 1.181 . . . . 0.0 108.39 -178.317 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 6' ' ' PRO . . . . . 0.418 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 12.3 Cg_exo -67.43 163.62 33.98 Favored 'Trans proline' 0 N--CA 1.443 -1.465 0 N-CA-C 115.778 1.415 . . . . 0.0 115.778 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -71.62 119.42 6.22 Favored 'Trans proline' 0 C--N 1.364 1.372 0 O-C-N 124.633 1.86 . . . . 0.0 108.589 175.428 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.353 0.726 0 CA-C-O 123.349 1.547 . . . . 0.0 109.167 178.668 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.613 ' HA ' HD12 ' A' ' 53' ' ' ILE . . . . . . . . 0 CA--C 1.554 1.104 0 CA-C-O 124.645 2.164 . . . . 0.0 109.764 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.629 HD13 ' HA ' ' A' ' 24' ' ' ILE . 11.4 mm -148.11 123.19 2.25 Favored 'Isoleucine or valine' 0 C--N 1.354 0.793 0 CA-C-N 109.04 -3.709 . . . . 0.0 106.391 -178.433 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.71 125.87 27.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.919 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -96.55 -22.89 16.8 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 113.119 -1.855 . . . . 0.0 114.215 -179.023 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -142.22 168.87 18.72 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 124.807 1.317 . . . . 0.0 107.75 -179.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -68.0 146.63 53.37 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 118.17 -1.412 . . . . 0.0 107.832 177.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -145.69 128.78 16.59 Favored 'General case' 0 C--N 1.355 0.841 0 C-N-CA 117.385 -1.726 . . . . 0.0 108.967 176.286 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.21 102.09 9.28 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-N 111.007 -2.815 . . . . 0.0 109.045 -178.106 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.05 170.02 0.01 OUTLIER 'General case' 0 C--N 1.382 1.996 0 CA-C-O 124.418 2.056 . . . . 0.0 113.28 -179.128 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.306 44.2 p -123.92 -25.15 4.29 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 109.886 -3.324 . . . . 0.0 111.175 -177.315 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.05 172.75 16.39 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 117.81 -1.556 . . . . 0.0 112.259 -174.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -59.84 -25.47 65.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 110.99 -2.823 . . . . 0.0 113.931 -177.034 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -87.32 -7.66 57.55 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 118.952 -1.099 . . . . 0.0 111.082 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -111.24 162.82 14.58 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 114.043 -1.435 . . . . 0.0 107.495 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.626 HD23 ' N ' ' A' ' 46' ' ' GLY . 0.4 OUTLIER -138.08 156.84 47.37 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 113.827 -1.533 . . . . 0.0 109.029 178.316 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' SER . . . . . 0.569 ' O ' HD12 ' A' ' 17' ' ' LEU . 3.1 m -86.59 162.9 17.75 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 123.425 1.583 . . . . 0.0 115.191 -178.259 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -162.74 167.77 22.51 Favored 'General case' 0 C--N 1.356 0.854 0 CA-C-N 109.307 -3.588 . . . . 0.0 107.871 175.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.52 147.11 52.17 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 111.005 -2.816 . . . . 0.0 104.71 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -43.04 99.49 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.707 0 O-C-N 125.835 1.96 . . . . 0.0 113.089 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.89 -34.41 1.86 Allowed Glycine 0 C--N 1.351 1.389 0 CA-C-N 113.623 -1.626 . . . . 0.0 115.527 177.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -45.85 151.82 0.42 Allowed 'General case' 0 C--N 1.359 1.016 0 N-CA-C 115.687 1.736 . . . . 0.0 115.687 -177.169 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.629 ' HA ' HD13 ' A' ' 4' ' ' ILE . 6.9 mt -100.62 121.66 51.67 Favored 'Isoleucine or valine' 0 C--N 1.35 0.622 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 176.2 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.709 HD11 HD11 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -106.86 140.96 38.86 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 -179.003 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.02 110.91 23.0 Favored 'General case' 0 C--O 1.209 -1.069 2 CA-C-N 107.181 -4.554 . . . . 0.0 107.622 -179.173 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 3.5 m -88.05 115.58 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 C-N-CA 118.703 -1.199 . . . . 0.0 110.7 -176.256 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.555 1.158 0 CA-C-N 113.017 -1.901 . . . . 0.0 110.831 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 . . . . . 0 CA--C 1.56 1.354 0 CA-C-O 119.89 -0.1 . . . . 0.0 110.763 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 69.4 m95 -129.65 174.3 9.82 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-O 121.8 0.809 . . . . 0.0 110.25 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -142.83 138.14 30.12 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 126.058 1.743 . . . . 0.0 107.145 174.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.6 tttm -100.2 114.87 28.61 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 175.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -136.08 172.69 12.65 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 118.671 -1.212 . . . . 0.0 111.578 -175.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -112.6 145.46 40.33 Favored 'General case' 0 C--N 1.367 1.355 0 O-C-N 125.481 1.738 . . . . 0.0 110.53 -177.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.709 HD11 HD11 ' A' ' 25' ' ' LEU 0.295 4.4 mt -159.22 135.6 9.14 Favored 'General case' 0 C--N 1.361 1.104 0 CA-C-N 109.086 -3.688 . . . . 0.0 112.794 178.815 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.87 28.43 10.43 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 112.431 -2.168 . . . . 0.0 114.971 170.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 72.37 29.14 66.59 Favored Glycine 0 CA--C 1.55 2.244 0 C-N-CA 119.775 -1.202 . . . . 0.0 114.067 -179.186 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -139.31 157.82 45.23 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 126.782 2.033 . . . . 0.0 107.711 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -139.73 142.28 36.83 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLY . . . . . 0.626 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -176.95 173.62 46.44 Favored Glycine 0 CA--C 1.53 1.024 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.874 -179.179 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -77.18 145.36 37.71 Favored 'General case' 0 CA--C 1.573 1.827 0 CA-C-O 122.834 1.302 . . . . 0.0 111.542 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.598 ' CD1' HD23 ' A' ' 25' ' ' LEU . 47.2 pt -143.73 143.89 25.11 Favored Pre-proline 0 C--N 1.355 0.827 0 CA-C-N 113.6 -1.636 . . . . 0.0 107.685 178.025 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.4 ' HG3' HG13 ' B' ' 5' ' ' VAL . 11.3 Cg_endo -73.06 144.91 38.66 Favored 'Trans proline' 0 C--N 1.346 0.447 0 N-CA-C 114.318 0.853 . . . . 0.0 114.318 -177.275 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.04 -40.79 71.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 115.071 -2.652 . . . . 0.0 111.985 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.453 HD22 ' HB2' ' B' ' 3' ' ' PRO . 10.5 p-10 -55.43 -19.39 9.15 Favored 'General case' 0 CA--C 1.562 1.411 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 177.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -93.25 -4.39 51.96 Favored 'General case' 0 C--N 1.366 1.309 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.613 HD12 ' HA ' ' A' ' 3' ' ' ALA . 0.4 OUTLIER -129.25 176.92 7.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.665 0 CA-C-O 122.991 1.377 . . . . 0.0 111.216 -179.412 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -132.32 138.53 47.83 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 110.807 -2.906 . . . . 0.0 104.942 177.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.35 0.611 0 O-C-N 124.25 0.969 . . . . 0.0 111.691 176.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 N--CA 1.44 -1.645 0 N-CA-C 114.378 0.876 . . . . 0.0 114.378 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.453 ' HB2' HD22 ' A' ' 51' ' ' ASN . 74.2 Cg_exo -51.79 162.09 1.89 Allowed 'Trans proline' 0 C--N 1.367 1.51 0 C-N-CA 122.602 2.201 . . . . 0.0 115.577 177.129 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -82.96 109.28 1.69 Allowed 'Trans proline' 0 CA--C 1.539 0.75 0 N-CA-C 105.931 -2.373 . . . . 0.0 105.931 175.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.461 HG12 ' HD2' ' B' ' 6' ' ' PRO . 2.5 t -49.1 148.05 4.48 Favored Pre-proline 0 CA--C 1.56 1.353 0 CA-C-N 113.563 -1.653 . . . . 0.0 111.802 -177.637 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 6' ' ' PRO . . . . . 0.461 ' HD2' HG12 ' B' ' 5' ' ' VAL . 26.8 Cg_exo -67.3 153.98 75.46 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 123.06 2.506 . . . . 0.0 115.689 178.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -65.85 114.35 2.92 Favored 'Trans proline' 0 C--N 1.372 1.794 0 N-CA-C 107.106 -1.921 . . . . 0.0 107.106 175.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.22 -0.482 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.4 ttm . . . . . 0 CA--C 1.539 0.525 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -115.21 153.13 31.42 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 123.317 1.532 . . . . 0.0 107.605 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.744 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . . . -137.87 156.04 48.33 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 110.248 -3.16 . . . . 0.0 107.46 -178.403 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.411 ' H ' HG13 ' A' ' 53' ' ' ILE . 47.4 mm -143.7 116.37 3.03 Favored 'Isoleucine or valine' 0 C--N 1.349 0.574 0 CA-C-N 112.484 -2.143 . . . . 0.0 109.623 -175.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.424 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -68.27 125.89 27.84 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.185 177.269 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.1 mmmt -97.35 -26.0 15.03 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.002 -0.999 . . . . 0.0 113.055 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -142.08 168.28 20.11 Favored 'General case' 0 C--N 1.351 0.645 0 O-C-N 125.031 1.457 . . . . 0.0 107.847 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -68.98 145.43 53.6 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 113.591 -1.64 . . . . 0.0 109.129 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -146.95 128.92 15.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 116.946 -1.902 . . . . 0.0 111.166 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.2 mmtp -120.49 112.94 19.59 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 112.346 -2.207 . . . . 0.0 108.028 179.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.84 158.88 0.19 Allowed 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 123.408 1.575 . . . . 0.0 113.938 -177.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.1 p -114.28 -22.47 9.91 Favored 'General case' 0 C--N 1.346 0.417 0 CA-C-N 110.719 -2.946 . . . . 0.0 112.258 -177.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -154.03 173.05 16.53 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 113.354 -1.748 . . . . 0.0 111.238 -177.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -54.96 -31.27 60.49 Favored 'General case' 0 CA--C 1.553 1.078 0 CA-C-N 110.278 -3.147 . . . . 0.0 114.478 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 55.0 p-10 -88.88 -2.7 58.72 Favored 'General case' 0 C--N 1.353 0.739 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -178.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -112.94 156.6 22.73 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.011 -1.45 . . . . 0.0 108.552 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.42 HD23 ' C ' ' A' ' 45' ' ' ASP . 2.8 pp -135.04 152.38 51.64 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 111.994 -2.366 . . . . 0.0 108.64 177.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . 0.281 57.7 m -82.23 170.88 14.91 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 112.013 -2.358 . . . . 0.0 112.462 -177.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -163.81 -176.58 4.67 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 108.709 -3.86 . . . . 0.0 106.501 172.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.27 144.54 36.51 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.87 102.16 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.247 0 O-C-N 125.068 1.48 . . . . 0.0 112.514 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.424 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 136.25 -24.03 3.27 Favored Glycine 0 C--N 1.355 1.635 0 CA-C-N 115.016 -0.993 . . . . 0.0 114.584 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.402 ' HB3' HD21 ' A' ' 41' ' ' LEU . 4.1 m-20 -50.49 142.48 10.55 Favored 'General case' 0 C--N 1.359 1.01 0 CA-C-O 122.8 1.286 . . . . 0.0 114.2 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.7 mm -99.0 116.67 42.65 Favored 'Isoleucine or valine' 0 C--N 1.348 0.533 0 N-CA-C 102.156 -3.276 . . . . 0.0 102.156 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.744 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 3.1 mp -107.2 155.04 20.35 Favored 'General case' 0 C--N 1.349 0.545 0 O-C-N 124.606 1.191 . . . . 0.0 111.547 -176.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.63 110.92 23.01 Favored 'General case' 0 C--N 1.355 0.807 0 CA-C-N 111.343 -2.662 . . . . 0.0 108.854 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.603 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 58.9 t -87.42 106.96 16.67 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 C-N-CA 116.915 -1.914 . . . . 0.0 110.016 -176.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.7 tp -94.26 -99.16 0.15 Allowed 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 112.148 -2.296 . . . . 0.0 107.516 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -74.97 160.27 30.77 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-O 122.706 1.241 . . . . 0.0 110.265 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -168.93 105.32 0.41 Allowed 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 111.766 -2.47 . . . . 0.0 105.495 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -84.04 29.01 0.57 Allowed 'General case' 0 C--N 1.358 0.967 0 CA-C-N 113.495 -1.684 . . . . 0.0 113.665 -178.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 96.8 m 58.51 23.57 10.92 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 112.622 -2.081 . . . . 0.0 113.339 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.76 147.13 53.02 Favored 'General case' 0 C--N 1.356 0.874 0 N-CA-C 107.151 -1.426 . . . . 0.0 107.151 177.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 28.2 pt20 -108.34 44.9 1.06 Allowed 'General case' 0 C--O 1.223 -0.309 0 CA-C-N 112.596 -2.093 . . . . 0.0 111.37 -177.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 49.5 m-20 -169.41 -18.14 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 111.576 -2.556 . . . . 0.0 113.212 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -140.26 166.41 24.75 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.776 0.798 . . . . 0.0 112.346 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -142.22 146.17 34.89 Favored 'General case' 0 C--N 1.357 0.923 0 CA-C-N 113.228 -1.806 . . . . 0.0 109.648 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.9 tttt -101.54 118.99 38.08 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 175.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.27 172.11 13.13 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 119.101 -1.04 . . . . 0.0 111.841 -177.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -109.77 136.23 49.42 Favored 'General case' 0 C--N 1.36 1.036 0 CA-C-N 114.128 -1.396 . . . . 0.0 111.227 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.402 HD21 ' HB3' ' A' ' 23' ' ' ASP 0.283 11.2 mt -160.13 136.02 8.49 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-N 111.755 -2.475 . . . . 0.0 114.611 179.477 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 57.3 21.49 6.77 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 110.731 -2.94 . . . . 0.0 116.32 170.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 94.74 10.7 57.56 Favored Glycine 0 CA--C 1.538 1.489 0 O-C-N 124.299 0.999 . . . . 0.0 113.557 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -132.01 169.42 16.36 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-O 122.137 0.97 . . . . 0.0 108.939 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.42 ' C ' HD23 ' A' ' 17' ' ' LEU . 8.7 p-10 -141.51 129.82 22.34 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 112.37 -2.196 . . . . 0.0 107.51 179.253 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.07 -179.96 43.32 Favored Glycine 0 C--N 1.348 1.244 0 C-N-CA 118.768 -1.682 . . . . 0.0 111.842 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -77.52 146.34 36.42 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 113.121 -1.539 . . . . 0.0 110.825 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.741 HD13 HD22 ' A' ' 25' ' ' LEU . 2.6 pt -142.83 144.26 28.86 Favored Pre-proline 0 CA--C 1.542 0.666 0 CA-C-N 111.125 -2.761 . . . . 0.0 106.843 179.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -79.2 145.79 19.45 Favored 'Trans proline' 0 C--N 1.364 1.377 0 N-CA-C 115.417 1.276 . . . . 0.0 115.417 -178.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -67.37 -44.24 79.43 Favored 'General case' 0 C--N 1.358 0.958 0 CA-C-N 113.996 -1.456 . . . . 0.0 111.568 -177.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.292 0.7 OUTLIER -67.36 -10.21 48.88 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 116.794 -1.962 . . . . 0.0 114.255 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -93.62 -10.2 35.44 Favored 'General case' 0 C--N 1.359 1.003 0 CA-C-O 118.417 -0.802 . . . . 0.0 111.474 176.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.677 ' CD1' ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -131.07 175.12 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-O 122.93 1.347 . . . . 0.0 110.088 179.864 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.516 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 33.3 tt0 -135.67 133.79 38.52 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 111.931 -2.395 . . . . 0.0 106.666 176.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 5.5 mtm -85.87 158.74 19.86 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-N 114.55 -1.205 . . . . 0.0 109.481 178.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.5 mtpp -152.79 95.06 3.07 Favored Pre-proline 0 CA--C 1.561 1.375 0 CA-C-N 113.332 -1.758 . . . . 0.0 110.157 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo . . . . . 0 C--N 1.371 1.738 0 C-N-CA 122.129 1.886 . . . . 0.0 112.971 177.835 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.291 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 97.5 t -77.75 116.55 59.24 Favored Pre-proline 0 CA--C 1.544 0.722 0 N-CA-C 105.082 -2.192 . . . . 0.0 105.082 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -69.78 159.67 52.55 Favored 'Trans proline' 0 C--N 1.364 1.364 0 N-CA-C 115.069 1.142 . . . . 0.0 115.069 178.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -55.84 159.67 11.31 Favored 'Trans proline' 0 C--N 1.365 1.439 0 C-N-CA 122.453 2.102 . . . . 0.0 116.813 177.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -72.13 127.29 12.61 Favored 'Trans proline' 0 C--N 1.365 1.4 0 N-CA-C 105.822 -2.415 . . . . 0.0 105.822 173.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.452 HG12 ' HD2' ' B' ' 6' ' ' PRO . 3.0 t -71.33 149.55 94.02 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 118.107 -1.437 . . . . 0.0 109.438 -177.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' PRO . . . . . 0.452 ' HD2' HG12 ' B' ' 5' ' ' VAL . 15.7 Cg_exo -71.09 155.25 61.77 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 O-C-N 123.539 1.284 . . . . 0.0 114.797 178.204 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -70.54 123.42 9.83 Favored 'Trans proline' 0 CA--C 1.548 1.186 0 N-CA-C 106.306 -2.228 . . . . 0.0 106.306 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.92 156.65 36.13 Favored 'General case' 0 C--N 1.352 0.705 0 C-N-CA 118.639 -1.224 . . . . 0.0 109.046 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 8.2 mmm-85 72.1 43.34 0.53 Allowed 'General case' 0 CA--C 1.543 0.712 0 CA-C-N 112.841 -1.981 . . . . 0.0 111.954 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.85 107.15 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.339 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.921 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.29 0 CA-C-N 114.435 -1.257 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 ttt . . . . . 0 N--CA 1.443 -0.822 0 CA-C-O 122.32 1.057 . . . . 0.0 108.419 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -115.77 151.6 34.87 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 111.254 -2.703 . . . . 0.0 107.393 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.703 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . -139.57 156.9 46.61 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 110.781 -2.918 . . . . 0.0 109.392 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.1 mt -147.0 116.17 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.646 0 CA-C-N 111.422 -2.626 . . . . 0.0 109.526 -178.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.27 129.51 40.13 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.747 177.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.0 mmmt -96.46 -23.67 16.47 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 113.797 -1.547 . . . . 0.0 113.291 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -141.92 168.81 18.88 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 125.203 1.564 . . . . 0.0 108.046 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -68.82 146.89 52.48 Favored 'General case' 0 C--N 1.357 0.892 0 CA-C-N 113.283 -1.781 . . . . 0.0 107.429 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -146.87 133.6 20.0 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 117.4 -1.72 . . . . 0.0 108.837 176.152 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm -122.08 112.17 17.91 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 113.88 -1.509 . . . . 0.0 107.056 177.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.9 154.63 0.7 Allowed 'General case' 0 C--N 1.381 1.943 0 CA-C-O 121.942 0.877 . . . . 0.0 112.639 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.9 p -113.26 -17.2 12.38 Favored 'General case' 0 C--N 1.36 1.035 0 CA-C-N 112.372 -2.195 . . . . 0.0 113.964 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.58 163.25 39.47 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 114.226 -1.352 . . . . 0.0 109.041 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -52.12 -30.63 27.19 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 110.709 -2.95 . . . . 0.0 115.008 -177.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 48.1 p-10 -87.97 -1.5 58.03 Favored 'General case' 0 C--N 1.358 0.971 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -177.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -109.1 160.04 16.38 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 113.835 -1.53 . . . . 0.0 108.125 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.601 HD12 ' O ' ' A' ' 18' ' ' SER . 0.4 OUTLIER -135.13 151.88 51.11 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 179.12 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.601 ' O ' HD12 ' A' ' 17' ' ' LEU . 25.9 m -83.04 168.27 17.09 Favored 'General case' 0 CA--C 1.56 1.365 0 CA-C-N 112.851 -1.977 . . . . 0.0 113.753 -178.287 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -164.08 -174.19 3.47 Favored 'General case' 0 C--N 1.354 0.766 0 CA-C-N 112.591 -2.095 . . . . 0.0 107.818 173.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.86 146.22 40.95 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 112.968 -1.924 . . . . 0.0 105.842 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -47.23 102.48 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.254 0 O-C-N 125.575 1.797 . . . . 0.0 111.537 178.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 127.05 -16.38 6.41 Favored Glycine 0 CA--C 1.541 1.678 0 CA-C-N 113.327 -1.76 . . . . 0.0 116.055 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -52.42 147.75 7.72 Favored 'General case' 0 C--N 1.365 1.255 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -177.033 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 88.0 mt -99.14 113.43 34.03 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 175.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.582 HD22 HD13 ' A' ' 48' ' ' ILE . 4.5 mp -107.71 160.05 16.01 Favored 'General case' 0 C--N 1.35 0.627 0 CA-C-O 122.86 1.314 . . . . 0.0 110.664 -178.325 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.4 ttmt -101.6 112.35 24.89 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 109.911 -3.313 . . . . 0.0 106.747 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.536 HG23 ' HB2' ' A' ' 3' ' ' ALA . 25.0 t -87.8 98.1 7.23 Favored 'Isoleucine or valine' 0 C--N 1.349 0.558 0 C-N-CA 113.058 -3.457 . . . . 0.0 108.494 -177.191 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.81 93.54 6.74 Favored 'General case' 0 C--N 1.353 0.721 0 CA-C-N 112.587 -2.097 . . . . 0.0 107.185 177.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.8 t30 90.44 137.92 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 113.487 -1.688 . . . . 0.0 108.984 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -155.37 102.88 2.29 Favored 'General case' 0 C--N 1.35 0.626 0 CA-C-N 111.082 -2.781 . . . . 0.0 106.869 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 137.76 121.41 0.0 OUTLIER 'General case' 0 C--N 1.355 0.841 0 C-N-CA 129.176 2.991 . . . . 0.0 107.738 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 p 160.76 -41.86 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 113.03 -1.896 . . . . 0.0 110.933 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -153.06 108.57 3.27 Favored 'General case' 0 C--N 1.349 0.581 0 N-CA-C 105.885 -1.894 . . . . 0.0 105.885 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -72.89 107.66 5.4 Favored 'General case' 0 C--N 1.353 0.751 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 -178.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 141.41 -15.85 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 128.34 2.656 . . . . 0.0 112.573 -178.399 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -137.97 153.94 49.4 Favored 'General case' 0 C--N 1.363 1.155 0 O-C-N 123.638 0.586 . . . . 0.0 109.997 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -130.61 151.54 50.96 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -100.72 122.17 42.91 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 178.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -143.53 168.13 20.59 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 118.736 -1.186 . . . . 0.0 113.61 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -111.59 135.16 52.55 Favored 'General case' 0 C--N 1.368 1.387 0 O-C-N 125.396 1.685 . . . . 0.0 111.13 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.572 ' HB2' HD11 ' A' ' 17' ' ' LEU 0.298 12.4 mt -162.97 143.77 9.55 Favored 'General case' 0 C--N 1.345 0.372 0 CA-C-N 110.695 -2.957 . . . . 0.0 113.93 177.773 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.58 29.62 18.71 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 110.479 -3.055 . . . . 0.0 115.501 170.524 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 75.77 18.61 79.57 Favored Glycine 0 CA--C 1.545 1.954 0 CA-C-N 114.434 -1.257 . . . . 0.0 114.088 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -138.93 171.38 14.42 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 124.828 1.251 . . . . 0.0 109.352 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -143.05 139.67 30.62 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 112.145 -2.298 . . . . 0.0 108.252 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.575 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -179.24 177.37 48.35 Favored Glycine 0 C--N 1.349 1.264 0 C-N-CA 118.977 -1.582 . . . . 0.0 112.386 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -77.68 145.92 36.34 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-N 113.311 -1.445 . . . . 0.0 110.164 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.582 HD13 HD22 ' A' ' 25' ' ' LEU . 1.6 pt -141.79 144.78 34.1 Favored Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 111.961 -2.381 . . . . 0.0 107.56 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -76.7 149.58 30.16 Favored 'Trans proline' 0 C--N 1.369 1.629 0 N-CA-C 116.028 1.511 . . . . 0.0 116.028 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.15 -49.26 62.14 Favored 'General case' 0 C--N 1.353 0.732 0 CA-C-N 112.718 -2.037 . . . . 0.0 111.434 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.253 0.7 OUTLIER -65.54 -7.58 15.33 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 117.08 -1.848 . . . . 0.0 115.92 -179.307 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.406 ' CE1' HG22 ' B' ' 5' ' ' VAL . 8.4 m-85 -93.04 -11.1 33.89 Favored 'General case' 0 C--N 1.358 0.97 0 CA-C-O 118.34 -0.838 . . . . 0.0 112.495 177.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.703 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -128.06 170.32 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-O 122.346 1.07 . . . . 0.0 108.82 178.52 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.469 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 17.7 tt0 -128.46 132.96 48.42 Favored 'General case' 0 C--N 1.354 0.775 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -84.91 167.98 15.45 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 112.437 -2.165 . . . . 0.0 111.036 -179.507 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -152.12 86.72 4.41 Favored Pre-proline 0 CA--C 1.547 0.853 0 CA-C-N 110.521 -3.036 . . . . 0.0 105.49 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo . . . . . 0 C--N 1.377 2.05 0 C-N-CA 123.349 2.7 . . . . 0.0 116.956 -178.942 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.373 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 13.1 p -44.99 122.41 4.82 Favored Pre-proline 0 CA--C 1.544 0.728 0 O-C-N 124.884 1.365 . . . . 0.0 111.406 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -70.97 159.77 51.46 Favored 'Trans proline' 0 CA--C 1.553 1.471 0 N-CA-C 117.245 1.979 . . . . 0.0 117.245 178.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -59.21 160.31 19.68 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 124.341 3.361 . . . . 0.0 117.01 177.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -76.17 118.9 5.12 Favored 'Trans proline' 0 C--N 1.368 1.563 0 N-CA-C 106.314 -2.226 . . . . 0.0 106.314 174.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.445 HG12 ' HD2' ' B' ' 6' ' ' PRO . 3.1 t -62.73 147.35 93.37 Favored Pre-proline 0 CA--C 1.538 0.515 0 CA-C-N 113.001 -1.909 . . . . 0.0 109.739 -178.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 6' ' ' PRO . . . . . 0.445 ' HD2' HG12 ' B' ' 5' ' ' VAL . 18.1 Cg_exo -66.66 157.41 61.06 Favored 'Trans proline' 0 C--N 1.359 1.097 0 O-C-N 123.137 1.072 . . . . 0.0 114.468 178.552 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -67.69 120.88 7.9 Favored 'Trans proline' 0 C--N 1.365 1.411 0 N-CA-C 105.904 -2.383 . . . . 0.0 105.904 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.27 79.56 8.5 Favored 'General case' 0 C--N 1.357 0.928 0 O-C-N 124.492 1.12 . . . . 0.0 110.778 -178.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 14.4 ptt180 164.36 56.99 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 110.71 -2.95 . . . . 0.0 111.236 178.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 61.35 92.38 0.05 Allowed 'General case' 0 CA--C 1.552 1.035 0 CA-C-O 122.84 1.305 . . . . 0.0 112.414 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.157 0 CA-C-N 112.856 -1.975 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.7 ttp . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -109.5 149.26 29.87 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 112.622 -2.081 . . . . 0.0 105.651 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.703 ' HB2' ' CG2' ' A' ' 27' ' ' VAL . . . -139.31 153.38 47.73 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 111.761 -2.472 . . . . 0.0 109.362 -177.064 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.1 mt -149.03 120.03 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.635 0 CA-C-N 112.297 -2.229 . . . . 0.0 108.745 -177.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 128.38 36.35 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.602 -1.635 . . . . 0.0 111.883 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.45 -24.77 15.95 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 114.42 -1.263 . . . . 0.0 113.315 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -139.89 167.61 21.72 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 118.946 -1.102 . . . . 0.0 108.781 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -67.61 145.98 54.31 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 113.725 -1.579 . . . . 0.0 108.135 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -146.66 136.5 23.27 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 122.6 1.191 . . . . 0.0 109.591 176.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.13 106.57 9.66 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 112.776 -2.011 . . . . 0.0 108.003 178.08 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.11 157.97 0.16 Allowed 'General case' 0 C--N 1.36 1.023 0 CA-C-O 122.631 1.205 . . . . 0.0 113.753 -178.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.9 p -112.84 -17.96 12.39 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 110.942 -2.845 . . . . 0.0 112.054 -177.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.71 169.02 24.34 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 123.071 1.415 . . . . 0.0 111.812 -176.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -50.53 -36.36 33.89 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 110.59 -3.004 . . . . 0.0 112.913 -179.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 39.3 p30 -87.38 -1.4 57.9 Favored 'General case' 0 C--N 1.356 0.851 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -107.69 157.75 17.84 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 124.368 1.042 . . . . 0.0 108.419 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.605 HD23 ' N ' ' A' ' 46' ' ' GLY . 0.3 OUTLIER -132.74 155.12 49.45 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 114.047 -1.433 . . . . 0.0 107.187 178.621 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.59 ' O ' HD12 ' A' ' 17' ' ' LEU . 4.8 m -84.3 171.5 12.65 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 123.661 1.696 . . . . 0.0 114.055 -178.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -167.43 163.62 14.98 Favored 'General case' 0 C--N 1.347 0.465 0 CA-C-N 111.364 -2.653 . . . . 0.0 107.976 174.319 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -127.39 141.06 51.79 Favored 'General case' 0 C--O 1.223 -0.316 0 N-CA-C 105.45 -2.055 . . . . 0.0 105.45 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -40.81 99.63 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.061 0 O-C-N 125.986 2.054 . . . . 0.0 113.843 -176.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 129.55 -7.75 6.21 Favored Glycine 0 C--N 1.36 1.884 0 CA-C-N 113.562 -1.654 . . . . 0.0 116.115 178.312 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.573 ' HB3' HD21 ' A' ' 41' ' ' LEU . 11.2 m-20 -61.61 146.76 47.92 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 117.334 -1.746 . . . . 0.0 112.783 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 26.6 mm -99.08 112.85 32.3 Favored 'Isoleucine or valine' 0 C--N 1.347 0.474 0 N-CA-C 104.516 -2.401 . . . . 0.0 104.516 177.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.692 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 5.1 mp -107.16 160.92 15.21 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 118.301 -1.36 . . . . 0.0 111.693 -175.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.08 113.97 27.89 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 110.403 -3.089 . . . . 0.0 107.737 177.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.703 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 57.5 t -85.86 121.29 37.13 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 C-N-CA 116.486 -2.086 . . . . 0.0 106.885 -177.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 27.2 tp -142.29 84.74 1.88 Allowed 'General case' 0 C--N 1.345 0.39 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.581 -175.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.5 m120 106.89 148.46 0.01 OUTLIER 'General case' 0 C--N 1.35 0.604 0 CA-C-N 110.783 -2.917 . . . . 0.0 108.297 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -175.93 74.71 0.02 OUTLIER 'General case' 0 C--N 1.348 0.529 0 CA-C-N 112.547 -2.115 . . . . 0.0 106.975 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -166.96 72.59 0.13 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 111.572 -2.558 . . . . 0.0 108.471 -177.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.3 t -158.39 -43.61 0.06 Allowed 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 111.207 -2.724 . . . . 0.0 110.747 178.363 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -162.3 120.83 2.22 Favored 'General case' 0 C--N 1.36 1.03 0 O-C-N 124.096 0.873 . . . . 0.0 109.702 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -69.82 110.29 4.89 Favored 'General case' 0 C--N 1.351 0.653 0 N-CA-C 105.232 -2.136 . . . . 0.0 105.232 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.6 m120 143.77 -14.43 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 O-C-N 126.225 2.203 . . . . 0.0 111.554 -179.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.8 m95 -136.91 153.28 50.78 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -178.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -127.02 147.97 50.13 Favored 'General case' 0 C--N 1.355 0.846 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 178.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -102.03 116.28 32.35 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 104.133 -2.544 . . . . 0.0 104.133 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.38 173.74 11.29 Favored 'General case' 0 C--N 1.349 0.574 0 C-N-CA 119.086 -1.046 . . . . 0.0 111.154 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -109.26 141.83 41.0 Favored 'General case' 0 C--N 1.359 1.003 0 O-C-N 125.64 1.837 . . . . 0.0 110.675 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.573 HD21 ' HB3' ' A' ' 23' ' ' ASP . 8.3 mt -158.66 119.47 3.33 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 110.575 -3.011 . . . . 0.0 115.76 179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.367 0.0 OUTLIER 61.87 33.17 17.74 Favored 'General case' 0 C--N 1.384 2.092 1 C-N-CA 110.051 -4.66 . . . . 0.0 118.564 173.671 . . . . . . . . 4 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.62 22.39 59.28 Favored Glycine 0 CA--C 1.546 2.022 0 C-N-CA 116.227 -2.892 . . . . 0.0 112.384 -178.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.45 137.22 47.18 Favored 'General case' 0 C--N 1.353 0.72 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 179.424 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 18.4 p-10 -130.17 145.77 51.75 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 -178.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.605 ' N ' HD23 ' A' ' 17' ' ' LEU . . . 176.19 178.79 46.25 Favored Glycine 0 C--N 1.34 0.769 0 C-N-CA 116.313 -2.851 . . . . 0.0 112.388 -178.5 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -76.93 143.03 39.82 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-O 123.414 1.578 . . . . 0.0 109.331 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.2 pt -143.37 144.19 27.12 Favored Pre-proline 0 C--O 1.218 -0.556 0 CA-C-N 111.412 -2.631 . . . . 0.0 106.195 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -77.09 147.53 26.58 Favored 'Trans proline' 0 C--N 1.356 0.968 0 N-CA-C 116.237 1.591 . . . . 0.0 116.237 -177.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.14 -45.76 66.14 Favored 'General case' 0 C--N 1.358 0.938 0 C-N-CA 116.922 -1.911 . . . . 0.0 110.843 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.313 0.5 OUTLIER -62.6 -7.38 4.64 Favored 'General case' 0 CA--C 1.557 1.235 0 C-N-CA 115.137 -2.625 . . . . 0.0 115.617 -177.838 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.704 ' CE1' HG22 ' B' ' 5' ' ' VAL . 6.8 m-85 -93.42 -10.52 34.86 Favored 'General case' 0 CA--C 1.559 1.302 0 CA-C-O 118.738 -0.648 . . . . 0.0 111.611 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.703 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -127.3 168.85 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-O 122.314 1.054 . . . . 0.0 108.707 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.433 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 3.5 tt0 -120.94 136.66 54.91 Favored 'General case' 0 C--N 1.352 0.694 0 N-CA-C 103.11 -2.922 . . . . 0.0 103.11 176.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.89 168.7 14.8 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 113.233 -1.803 . . . . 0.0 110.212 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -151.12 79.27 6.93 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-N 112.009 -2.359 . . . . 0.0 106.348 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo . . . . . 0 C--N 1.368 1.554 0 O-C-N 124.218 1.641 . . . . 0.0 111.723 179.742 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.258 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 69.1 t -52.28 110.13 1.76 Allowed Pre-proline 0 C--N 1.349 0.585 0 O-C-N 125.508 1.755 . . . . 0.0 111.838 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -76.63 158.72 35.74 Favored 'Trans proline' 0 N--CA 1.436 -1.91 0 N-CA-C 115.563 1.332 . . . . 0.0 115.563 176.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -58.95 158.41 25.17 Favored 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 122.36 2.04 . . . . 0.0 115.89 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -70.14 119.57 6.47 Favored 'Trans proline' 0 C--N 1.362 1.271 0 N-CA-C 106.07 -2.319 . . . . 0.0 106.07 175.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.704 HG22 ' CE1' ' A' ' 52' ' ' TYR . 16.6 t -64.63 149.34 95.76 Favored Pre-proline 0 CA--C 1.543 0.7 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.995 -177.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 6' ' ' PRO . . . . . 0.403 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 20.2 Cg_exo -66.05 158.66 53.22 Favored 'Trans proline' 0 C--N 1.362 1.256 0 O-C-N 123.052 1.027 . . . . 0.0 114.361 178.163 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -78.89 118.52 4.12 Favored 'Trans proline' 0 C--N 1.358 1.027 0 N-CA-C 106.549 -2.135 . . . . 0.0 106.549 176.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.17 156.6 28.14 Favored 'General case' 0 C--N 1.352 0.694 0 C-N-CA 117.287 -1.765 . . . . 0.0 109.2 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.5 mtm105 60.14 42.82 14.94 Favored 'General case' 0 C--N 1.35 0.587 0 CA-C-N 112.401 -2.181 . . . . 0.0 112.93 178.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 30.96 79.56 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 O-C-N 125.982 2.051 . . . . 0.0 112.663 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 110.865 -2.88 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 ttp . . . . . 0 N--CA 1.448 -0.572 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -112.39 149.66 32.21 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 112.963 -1.926 . . . . 0.0 106.748 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.629 ' HB2' ' CG2' ' A' ' 27' ' ' VAL . . . -137.41 161.7 35.62 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 111.572 -2.558 . . . . 0.0 108.68 -178.016 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.275 16.4 mm -145.47 118.39 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-N 110.587 -3.006 . . . . 0.0 108.888 -176.157 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.552 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -68.45 125.54 26.81 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 117.054 -1.858 . . . . 0.0 107.83 176.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.8 mtmt -95.2 -24.89 16.61 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.519 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 52.2 m-85 -141.46 167.41 22.23 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -67.93 147.0 53.07 Favored 'General case' 0 C--N 1.352 0.698 0 CA-C-N 114.049 -1.432 . . . . 0.0 107.494 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -147.37 129.64 15.66 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 116.819 -1.952 . . . . 0.0 110.214 176.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.406 ' H ' ' HD3' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -121.5 116.42 24.66 Favored 'General case' 0 CA--C 1.569 1.687 0 CA-C-N 113.699 -1.591 . . . . 0.0 107.407 177.543 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.58 159.87 0.09 Allowed 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 123.537 1.637 . . . . 0.0 115.185 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 28.4 p -119.14 -15.64 9.19 Favored 'General case' 0 C--N 1.353 0.751 0 CA-C-N 110.162 -3.199 . . . . 0.0 114.057 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.09 160.45 43.43 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 123.052 1.406 . . . . 0.0 111.443 -178.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -49.28 -32.2 10.42 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-N 111.066 -2.788 . . . . 0.0 113.462 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -89.32 -2.16 58.34 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.988 1.847 . . . . 0.0 115.988 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -106.89 162.82 13.48 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 114.051 -1.432 . . . . 0.0 107.761 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.637 HD12 ' O ' ' A' ' 18' ' ' SER . 0.4 OUTLIER -134.58 152.4 51.75 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.058 -1.428 . . . . 0.0 107.824 179.443 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.637 ' O ' HD12 ' A' ' 17' ' ' LEU . 4.2 m -85.0 164.76 18.07 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 124.31 2.005 . . . . 0.0 113.048 -178.115 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -162.16 178.59 8.63 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 111.431 -2.622 . . . . 0.0 108.168 173.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.19 145.98 44.35 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 111.853 -2.431 . . . . 0.0 104.723 -178.28 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -47.48 100.43 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 O-C-N 125.69 1.869 . . . . 0.0 112.191 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.552 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 130.59 -14.7 5.54 Favored Glycine 0 C--N 1.353 1.482 0 CA-C-O 118.634 -1.092 . . . . 0.0 115.548 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.684 ' HB3' HD21 ' A' ' 41' ' ' LEU . 37.5 m-20 -53.71 146.09 14.19 Favored 'General case' 0 C--N 1.365 1.269 0 C-N-CA 118.746 -1.182 . . . . 0.0 112.289 -179.46 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.3 mm -95.6 116.45 37.28 Favored 'Isoleucine or valine' 0 C--N 1.352 0.688 0 N-CA-C 100.876 -3.75 . . . . 0.0 100.876 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.596 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 0.6 OUTLIER -106.61 153.19 22.72 Favored 'General case' 0 C--N 1.348 0.52 0 CA-C-N 113.174 -1.83 . . . . 0.0 111.363 -175.345 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -104.58 109.06 20.81 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 109.798 -3.364 . . . . 0.0 109.288 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.629 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 55.8 t -86.92 110.31 20.18 Favored 'Isoleucine or valine' 0 C--N 1.344 0.356 0 C-N-CA 116.687 -2.005 . . . . 0.0 110.065 -176.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.2 tp -93.62 -108.31 0.12 Allowed 'General case' 0 CA--C 1.551 0.984 0 CA-C-N 112.792 -2.003 . . . . 0.0 109.325 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -74.32 -179.69 4.07 Favored 'General case' 0 C--N 1.359 1.006 0 CA-C-O 121.702 0.763 . . . . 0.0 111.185 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 172.36 60.11 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 112.559 -2.109 . . . . 0.0 109.931 179.07 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . 0.259 18.0 pt-20 -75.1 -133.27 0.01 OUTLIER 'General case' 0 C--N 1.353 0.749 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.404 178.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 39.2 t -34.56 -47.55 0.33 Allowed 'General case' 0 CA--C 1.551 0.993 0 CA-C-N 112.841 -1.981 . . . . 0.0 113.817 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.4 p30 -51.28 105.93 0.12 Allowed 'General case' 0 C--N 1.357 0.924 0 CA-C-O 123.14 1.447 . . . . 0.0 112.855 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.15 -37.43 17.35 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 112.429 -2.169 . . . . 0.0 112.865 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -92.1 -14.94 28.44 Favored 'General case' 0 N--CA 1.436 -1.135 1 C-N-CA 134.36 5.064 . . . . 0.0 113.519 -176.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -135.21 159.27 42.07 Favored 'General case' 0 CA--C 1.553 1.069 0 O-C-N 124.82 1.325 . . . . 0.0 109.218 -179.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -134.96 148.23 49.96 Favored 'General case' 0 C--N 1.354 0.78 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.5 ttpp -99.89 117.92 35.22 Favored 'General case' 0 C--N 1.354 0.799 0 N-CA-C 104.442 -2.429 . . . . 0.0 104.442 177.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.48 176.84 8.38 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 113.815 -1.539 . . . . 0.0 111.061 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -126.61 143.79 51.11 Favored 'General case' 0 C--N 1.356 0.871 0 O-C-N 125.33 1.644 . . . . 0.0 110.856 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.684 HD21 ' HB3' ' A' ' 23' ' ' ASP 0.289 10.8 mt -161.9 142.62 10.61 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 109.766 -3.379 . . . . 0.0 113.084 178.982 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.94 30.3 18.93 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 111.544 -2.571 . . . . 0.0 116.352 170.304 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.95 11.61 85.23 Favored Glycine 0 CA--C 1.545 1.95 0 C-N-CA 119.305 -1.426 . . . . 0.0 114.975 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -136.08 165.24 26.16 Favored 'General case' 0 C--N 1.352 0.689 0 C-N-CA 124.448 1.099 . . . . 0.0 108.055 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -139.44 139.06 36.96 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 112.84 -1.982 . . . . 0.0 108.011 -179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.535 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -172.48 178.26 44.67 Favored Glycine 0 C--N 1.344 0.988 0 C-N-CA 118.105 -1.998 . . . . 0.0 111.707 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -77.78 146.0 36.09 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 112.628 -1.786 . . . . 0.0 110.369 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.537 HD13 HD22 ' A' ' 25' ' ' LEU . 35.0 pt -141.88 143.27 27.95 Favored Pre-proline 0 C--N 1.349 0.551 0 CA-C-N 112.128 -2.306 . . . . 0.0 106.023 178.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -75.1 139.42 24.0 Favored 'Trans proline' 0 C--N 1.362 1.273 0 CA-C-N 118.972 0.669 . . . . 0.0 112.664 -178.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.7 pttp -70.05 -21.13 63.2 Favored 'General case' 0 C--N 1.358 0.974 0 C-N-CA 114.761 -2.776 . . . . 0.0 112.978 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.62 -18.9 61.55 Favored 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 113.544 -3.262 . . . . 0.0 111.329 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -87.54 -6.87 58.15 Favored 'General case' 0 C--N 1.367 1.358 0 O-C-N 123.851 0.719 . . . . 0.0 112.528 -175.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.605 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -129.76 172.28 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 CA-C-O 121.893 0.854 . . . . 0.0 108.827 177.75 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.459 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 2.4 tt0 -132.87 136.22 46.08 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 112.848 -1.978 . . . . 0.0 105.938 177.457 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 55.2 mtm -84.39 162.85 19.84 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 112.721 -2.036 . . . . 0.0 110.736 -179.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.2 mmtm -151.37 87.66 4.5 Favored Pre-proline 0 CA--C 1.551 0.983 0 CA-C-N 112.333 -2.212 . . . . 0.0 109.801 -178.039 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 C--N 1.367 1.552 0 C-N-CA 122.086 1.857 . . . . 0.0 111.473 177.817 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.272 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 39.1 t -78.03 107.45 5.53 Favored Pre-proline 0 CA--C 1.546 0.789 0 O-C-N 125.193 1.558 . . . . 0.0 107.107 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 2' ' ' PRO . . . . . 0.519 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 1.9 Cg_endo -66.29 158.5 54.67 Favored 'Trans proline' 0 CA--C 1.564 2.013 0 O-C-N 123.375 1.198 . . . . 0.0 115.007 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' B' ' 2' ' ' PRO . 75.2 Cg_exo -57.69 158.12 21.16 Favored 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 124.056 3.17 . . . . 0.0 117.627 179.187 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -71.61 114.05 3.83 Favored 'Trans proline' 0 C--N 1.357 0.989 0 N-CA-C 106.885 -2.006 . . . . 0.0 106.885 175.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.434 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.1 t -54.58 148.27 26.25 Favored Pre-proline 0 C--N 1.354 0.782 0 CA-C-N 113.473 -1.694 . . . . 0.0 109.864 -178.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' PRO . . . . . 0.434 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 21.0 Cg_exo -64.38 153.83 74.7 Favored 'Trans proline' 0 C--N 1.359 1.129 0 N-CA-C 114.977 1.107 . . . . 0.0 114.977 178.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -76.63 111.05 3.17 Favored 'Trans proline' 0 C--N 1.362 1.242 0 N-CA-C 107.462 -1.784 . . . . 0.0 107.462 176.328 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -90.52 138.72 31.33 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.395 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 ptt85 177.52 65.33 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 112.284 -2.235 . . . . 0.0 109.634 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.11 -80.26 0.06 Allowed 'General case' 0 C--N 1.347 0.492 0 CA-C-N 113.773 -1.558 . . . . 0.0 108.856 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.487 0 CA-C-N 111.044 -2.798 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ttm . . . . . 0 CA--C 1.537 0.48 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -92.54 152.92 19.37 Favored 'General case' 0 C--N 1.362 1.123 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 179.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.959 ' HB1' HD11 ' A' ' 53' ' ' ILE . . . -141.58 154.62 45.54 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 110.304 -3.134 . . . . 0.0 105.287 -177.015 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 mt -154.43 134.35 3.97 Favored 'Isoleucine or valine' 0 C--N 1.348 0.508 0 C-N-CA 117.553 -1.659 . . . . 0.0 109.59 -175.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.526 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -66.92 129.45 39.94 Favored 'General case' 0 CA--C 1.557 1.214 0 CA-C-N 112.504 -2.135 . . . . 0.0 109.596 177.138 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -97.44 -27.19 14.56 Favored 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 113.839 -1.528 . . . . 0.0 111.954 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.422 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 65.0 m-85 -142.44 170.46 15.66 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 113.32 -1.763 . . . . 0.0 106.956 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.32 142.87 47.1 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 118.807 -1.157 . . . . 0.0 108.413 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -147.18 127.17 13.63 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 117.418 -1.713 . . . . 0.0 111.225 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.94 118.78 33.9 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 112.763 -2.017 . . . . 0.0 108.142 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.85 151.53 1.2 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 122.181 0.991 . . . . 0.0 112.216 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.79 -11.0 9.06 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-N 112.06 -2.336 . . . . 0.0 112.126 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.43 164.99 37.21 Favored 'General case' 0 C--N 1.356 0.885 0 CA-C-O 123.847 1.784 . . . . 0.0 110.338 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -47.77 -34.67 8.81 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 108.842 -3.799 . . . . 0.0 114.697 -178.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -93.87 0.68 56.31 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 26.7 mp0 -112.97 154.55 26.27 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.399 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.441 HD23 ' C ' ' A' ' 45' ' ' ASP . 1.9 pp -134.54 154.92 51.22 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 112.807 -1.997 . . . . 0.0 109.854 177.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . 0.255 58.5 m -82.1 166.7 19.48 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 111.213 -2.721 . . . . 0.0 113.143 -177.159 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.9 p90 -163.9 -175.95 4.32 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 110.248 -3.16 . . . . 0.0 107.419 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.8 143.82 37.05 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 111.918 -2.401 . . . . 0.0 105.509 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -46.67 98.57 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.441 0 O-C-N 125.168 1.543 . . . . 0.0 112.866 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.526 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 131.11 -13.28 5.5 Favored Glycine 0 C--N 1.356 1.66 0 O-C-N 124.525 1.14 . . . . 0.0 115.535 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.457 ' HB3' HD21 ' A' ' 41' ' ' LEU . 1.8 m-20 -54.52 145.77 17.8 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 119.109 -1.037 . . . . 0.0 112.684 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.8 mm -97.0 117.0 40.74 Favored 'Isoleucine or valine' 0 C--N 1.352 0.686 0 N-CA-C 103.09 -2.93 . . . . 0.0 103.09 177.013 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.464 HD21 ' CD1' ' A' ' 41' ' ' LEU . 0.6 OUTLIER -111.04 148.48 32.52 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 112.173 -2.285 . . . . 0.0 112.542 -175.714 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.14 107.54 18.56 Favored 'General case' 0 C--O 1.213 -0.832 0 CA-C-N 110.705 -2.952 . . . . 0.0 108.475 178.153 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.414 HG13 ' CB ' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -86.34 99.0 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 C-N-CA 115.133 -2.627 . . . . 0.0 109.778 -176.814 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.1 tp -94.61 102.86 14.79 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 110.509 -3.041 . . . . 0.0 107.292 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 80.71 130.84 0.05 Allowed 'General case' 0 CA--C 1.551 0.997 0 O-C-N 125.265 1.603 . . . . 0.0 109.405 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -165.05 -175.4 3.68 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 111.576 -2.556 . . . . 0.0 106.813 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 75.25 68.08 0.08 Allowed 'General case' 0 C--N 1.354 0.801 0 CA-C-O 122.864 1.316 . . . . 0.0 109.956 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.7 m -166.86 -74.75 0.03 OUTLIER 'General case' 0 C--N 1.347 0.492 0 CA-C-N 111.284 -2.689 . . . . 0.0 106.748 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.7 139.52 36.1 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 113.541 -1.663 . . . . 0.0 107.129 -179.321 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -84.77 -23.28 29.28 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 116.191 1.922 . . . . 0.0 116.191 -175.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.537 ' HB2' HH21 ' B' ' 10' ' ' ARG . 19.9 m120 -117.29 -11.33 10.63 Favored 'General case' 0 N--CA 1.436 -1.125 0 C-N-CA 131.082 3.753 . . . . 0.0 115.288 -174.335 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.432 ' CE2' ' HB3' ' B' ' 8' ' ' ARG . 70.5 m95 -132.55 153.98 50.44 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 119.053 0.842 . . . . 0.0 110.929 -178.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.436 ' O ' ' HA ' ' A' ' 47' ' ' PHE 0.261 21.4 m-85 -133.46 148.51 51.74 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 114.595 -1.184 . . . . 0.0 108.514 177.634 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -99.19 119.35 37.72 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 179.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.04 172.54 12.54 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 119.181 -1.008 . . . . 0.0 112.162 -176.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -113.7 134.39 54.78 Favored 'General case' 0 C--N 1.362 1.139 0 O-C-N 125.15 1.531 . . . . 0.0 111.915 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.464 ' CD1' HD21 ' A' ' 25' ' ' LEU 0.342 9.4 mt -161.2 137.55 8.35 Favored 'General case' 0 C--N 1.355 0.813 0 CA-C-N 111.662 -2.517 . . . . 0.0 114.565 178.778 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.9 21.14 5.85 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 110.218 -3.174 . . . . 0.0 116.661 170.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 91.96 15.22 54.87 Favored Glycine 0 C--N 1.353 1.486 0 CA-C-N 114.359 -1.292 . . . . 0.0 113.287 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -134.3 166.74 22.11 Favored 'General case' 0 C--N 1.354 0.773 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.441 ' C ' HD23 ' A' ' 17' ' ' LEU . 5.6 p-10 -141.96 129.64 21.56 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 112.773 -2.012 . . . . 0.0 107.546 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.49 178.56 44.53 Favored Glycine 0 C--N 1.353 1.493 0 C-N-CA 119.318 -1.42 . . . . 0.0 111.995 -177.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PHE . . . . . 0.436 ' HA ' ' O ' ' A' ' 37' ' ' TYR . 69.3 m-85 -77.86 146.28 35.77 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 123.062 1.411 . . . . 0.0 113.481 -178.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.2 pt -141.18 144.15 33.54 Favored Pre-proline 0 C--N 1.354 0.788 0 CA-C-N 111.21 -2.723 . . . . 0.0 107.104 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.13 150.49 37.7 Favored 'Trans proline' 0 C--N 1.364 1.383 0 N-CA-C 116.327 1.626 . . . . 0.0 116.327 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . 0.342 0.1 OUTLIER -65.97 -45.39 81.87 Favored 'General case' 0 C--N 1.364 1.227 0 CA-C-N 114.043 -1.435 . . . . 0.0 111.446 179.622 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.319 5.2 p30 -68.66 -11.89 60.7 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 116.116 -2.234 . . . . 0.0 114.306 -178.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.445 ' CE1' HG22 ' B' ' 5' ' ' VAL . 9.2 m-85 -92.44 -12.56 31.79 Favored 'General case' 0 C--N 1.357 0.924 0 CA-C-O 117.754 -1.117 . . . . 0.0 112.374 177.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.959 HD11 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -133.14 168.67 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-O 122.303 1.049 . . . . 0.0 109.2 178.925 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.456 ' N ' HG13 ' A' ' 53' ' ' ILE . 2.0 tt0 -136.92 137.63 39.78 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 113.185 -1.825 . . . . 0.0 107.823 176.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.2 mtm -84.38 168.56 15.46 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 113.707 -1.588 . . . . 0.0 109.072 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -151.01 86.33 4.9 Favored Pre-proline 0 CA--C 1.551 0.996 0 CA-C-N 112.343 -2.208 . . . . 0.0 108.387 -178.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo . . . . . 0 C--N 1.374 1.877 0 C-N-CA 122.6 2.2 . . . . 0.0 110.37 178.441 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.282 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 18.9 t -129.09 89.09 49.46 Favored Pre-proline 0 C--N 1.348 0.541 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 2' ' ' PRO . . . . . 0.422 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 5.8 Cg_exo -60.31 161.12 20.94 Favored 'Trans proline' 0 C--N 1.365 1.404 0 O-C-N 123.193 1.101 . . . . 0.0 114.337 178.228 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -51.83 160.19 3.08 Favored 'Trans proline' 0 C--N 1.364 1.379 0 C-N-CA 122.652 2.235 . . . . 0.0 116.999 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -72.97 126.73 11.5 Favored 'Trans proline' 0 C--N 1.367 1.525 0 N-CA-C 105.762 -2.438 . . . . 0.0 105.762 175.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.445 HG22 ' CE1' ' A' ' 52' ' ' TYR . 10.7 t -70.74 146.71 93.8 Favored Pre-proline 0 CA--C 1.54 0.584 0 C-N-CA 117.688 -1.605 . . . . 0.0 108.92 -177.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 6' ' ' PRO . . . . . 0.416 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 12.5 Cg_exo -67.9 160.08 50.02 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 O-C-N 123.358 1.188 . . . . 0.0 114.806 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -78.57 116.54 3.83 Favored 'Trans proline' 0 CA--C 1.551 1.329 0 N-CA-C 108.405 -1.421 . . . . 0.0 108.405 176.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.432 ' HB3' ' CE2' ' A' ' 36' ' ' TRP . 0.0 OUTLIER -97.4 104.34 16.35 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 114.304 -1.316 . . . . 0.0 108.865 179.607 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -150.16 50.07 0.9 Allowed 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 112.961 -1.927 . . . . 0.0 110.245 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ARG . . . . . 0.537 HH21 ' HB2' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -178.29 155.06 0.88 Allowed 'General case' 0 C--N 1.358 0.964 0 CA-C-N 113.693 -1.594 . . . . 0.0 110.844 178.327 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.196 0 CA-C-N 113.802 -1.544 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.161 0 N-CA-C 106.382 -1.71 . . . . 0.0 106.382 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -110.82 147.54 34.3 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 104.598 -2.371 . . . . 0.0 104.598 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.641 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . -139.91 153.31 46.93 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 111.324 -2.671 . . . . 0.0 107.271 -177.033 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.1 mt -148.98 120.93 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 111.381 -2.645 . . . . 0.0 108.23 -176.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.96 134.08 49.05 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 113.325 -1.761 . . . . 0.0 108.401 176.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt -94.22 -22.3 18.5 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 124.415 1.086 . . . . 0.0 112.563 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.429 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 88.0 m-85 -142.33 170.29 15.98 Favored 'General case' 0 C--N 1.35 0.611 0 CA-C-N 113.935 -1.484 . . . . 0.0 108.394 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -72.51 149.29 44.24 Favored 'General case' 0 C--O 1.214 -0.8 0 CA-C-N 113.348 -1.751 . . . . 0.0 108.017 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.443 ' HE1' HG21 ' B' ' 5' ' ' VAL . 26.6 t80 -145.95 134.61 22.23 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 117.693 -1.603 . . . . 0.0 109.409 176.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -122.37 101.25 7.39 Favored 'General case' 0 CA--C 1.561 1.373 0 CA-C-N 111.694 -2.503 . . . . 0.0 109.773 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.55 152.69 0.89 Allowed 'General case' 0 C--N 1.362 1.131 0 CA-C-O 122.123 0.963 . . . . 0.0 113.028 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.1 p -118.84 -11.81 9.7 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-N 111.848 -2.433 . . . . 0.0 113.156 -177.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.22 163.58 38.53 Favored 'General case' 0 C--N 1.355 0.809 0 CA-C-O 123.323 1.535 . . . . 0.0 110.201 -178.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -49.08 -31.35 7.75 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 110.332 -3.122 . . . . 0.0 115.343 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 57.4 p30 -90.74 -4.13 56.93 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -109.77 158.09 18.48 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 113.693 -1.594 . . . . 0.0 107.791 -179.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.576 HD12 ' O ' ' A' ' 18' ' ' SER . 0.4 OUTLIER -133.41 152.22 51.89 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 111.624 -2.535 . . . . 0.0 108.134 178.441 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.576 ' O ' HD12 ' A' ' 17' ' ' LEU . 13.3 m -82.94 166.09 19.16 Favored 'General case' 0 C--N 1.354 0.765 0 CA-C-N 112.516 -2.129 . . . . 0.0 112.65 -178.15 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -163.7 -175.21 4.02 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 111.145 -2.752 . . . . 0.0 107.646 172.197 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -139.37 147.31 41.33 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.93 100.72 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.031 0 O-C-N 125.269 1.605 . . . . 0.0 112.651 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 129.7 -19.01 5.34 Favored Glycine 0 C--N 1.353 1.476 0 CA-C-O 117.94 -1.478 . . . . 0.0 115.415 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.467 ' HB3' HD21 ' A' ' 41' ' ' LEU . 76.8 m-20 -47.73 149.93 1.15 Allowed 'General case' 0 C--N 1.366 1.325 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -177.615 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mm -97.14 112.65 29.63 Favored 'Isoleucine or valine' 0 C--N 1.35 0.59 0 N-CA-C 103.54 -2.763 . . . . 0.0 103.54 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.849 HD11 HD11 ' A' ' 41' ' ' LEU . 3.1 mp -108.79 146.47 33.55 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-N 114.083 -1.417 . . . . 0.0 111.992 -175.332 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.34 112.49 25.4 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-N 111.877 -2.419 . . . . 0.0 107.546 179.175 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.629 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 12.0 t -87.87 99.58 8.98 Favored 'Isoleucine or valine' 0 C--N 1.352 0.679 0 C-N-CA 114.015 -3.074 . . . . 0.0 110.954 -175.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -94.03 93.28 7.76 Favored 'General case' 0 C--N 1.358 0.938 0 CA-C-N 112.976 -1.92 . . . . 0.0 106.009 177.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 80.93 139.39 0.07 Allowed 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 113.154 -1.839 . . . . 0.0 109.073 -178.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -158.53 54.26 0.43 Allowed 'General case' 0 C--N 1.352 0.698 0 CA-C-N 112.545 -2.116 . . . . 0.0 111.386 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . 0.253 0.0 OUTLIER -133.2 -44.06 0.85 Allowed 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.766 1.765 . . . . 0.0 115.766 -178.948 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 25.9 p -75.7 33.99 0.12 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 109.771 -3.377 . . . . 0.0 114.922 -177.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 178.89 126.75 0.06 Allowed 'General case' 0 CA--C 1.557 1.216 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 178.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -84.98 -27.11 26.7 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 -176.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 43.4 m-20 -113.32 -14.18 12.83 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 130.265 3.426 . . . . 0.0 113.884 -176.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -134.03 155.82 49.32 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -136.17 153.61 51.21 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 114.05 -1.432 . . . . 0.0 108.514 177.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.9 ttmt -100.69 123.45 44.91 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 106.525 -1.658 . . . . 0.0 106.525 177.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -142.05 173.44 11.52 Favored 'General case' 0 C--N 1.352 0.677 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.683 -178.156 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 50.8 tt0 -120.92 136.66 54.9 Favored 'General case' 0 C--N 1.367 1.339 0 O-C-N 124.939 1.399 . . . . 0.0 111.062 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.849 HD11 HD11 ' A' ' 25' ' ' LEU 0.264 12.3 mt -160.34 142.38 12.82 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 110.222 -3.172 . . . . 0.0 113.655 178.733 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.03 24.66 9.81 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 109.08 -3.691 . . . . 0.0 115.62 171.297 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.03 14.49 66.89 Favored Glycine 0 C--N 1.357 1.726 0 CA-C-N 114.64 -1.163 . . . . 0.0 113.867 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -134.35 168.13 19.47 Favored 'General case' 0 C--N 1.35 0.605 0 C-N-CA 125.013 1.325 . . . . 0.0 108.662 -179.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -139.49 141.51 37.35 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 112.401 -2.181 . . . . 0.0 107.74 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.568 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -177.91 177.95 48.42 Favored Glycine 0 C--N 1.348 1.227 0 C-N-CA 118.268 -1.92 . . . . 0.0 112.755 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -77.94 143.35 37.73 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 112.759 -1.72 . . . . 0.0 111.302 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.5 pt -141.89 143.39 28.4 Favored Pre-proline 0 C--N 1.351 0.662 0 CA-C-N 111.597 -2.547 . . . . 0.0 106.611 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -78.45 151.29 25.75 Favored 'Trans proline' 0 C--N 1.364 1.352 0 N-CA-C 116.775 1.798 . . . . 0.0 116.775 -177.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -44.12 81.93 Favored 'General case' 0 C--N 1.365 1.275 0 C-N-CA 118.159 -1.416 . . . . 0.0 112.002 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.323 0.7 OUTLIER -66.2 -10.77 44.89 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 116.263 -2.175 . . . . 0.0 115.839 -178.787 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.657 ' CE1' HG22 ' B' ' 5' ' ' VAL . 7.8 m-85 -93.96 -10.55 33.33 Favored 'General case' 0 C--N 1.357 0.923 0 CA-C-O 117.356 -1.307 . . . . 0.0 110.911 177.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.641 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -129.95 169.75 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 CA-C-O 123.071 1.415 . . . . 0.0 109.778 179.211 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.5 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 28.2 tt0 -135.35 133.51 38.84 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 111.179 -2.737 . . . . 0.0 106.198 177.029 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 38.0 mtp -84.99 160.87 19.96 Favored 'General case' 0 C--N 1.353 0.748 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.824 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -151.8 90.48 3.9 Favored Pre-proline 0 CA--C 1.554 1.102 0 CA-C-N 113.653 -1.612 . . . . 0.0 110.662 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo . . . . . 0 C--N 1.367 1.506 0 C-N-CA 122.793 2.329 . . . . 0.0 111.231 177.017 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.29 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 41.9 t -122.18 95.11 47.56 Favored Pre-proline 0 C--N 1.347 0.458 0 O-C-N 125.165 1.541 . . . . 0.0 107.612 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 2' ' ' PRO . . . . . 0.429 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 5.6 Cg_exo -67.58 165.76 26.29 Favored 'Trans proline' 0 N--CA 1.443 -1.454 0 O-C-N 123.122 1.064 . . . . 0.0 112.297 176.211 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -49.87 156.13 3.57 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.224 1.949 . . . . 0.0 115.846 178.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -70.43 128.06 14.9 Favored 'Trans proline' 0 C--N 1.365 1.435 0 N-CA-C 107.011 -1.957 . . . . 0.0 107.011 176.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.657 HG22 ' CE1' ' A' ' 52' ' ' TYR . 13.3 t -73.59 145.95 85.39 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-N 113.92 -1.491 . . . . 0.0 108.511 -177.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -64.35 158.47 48.82 Favored 'Trans proline' 0 C--N 1.358 1.072 0 O-C-N 123.3 1.158 . . . . 0.0 114.535 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.55 118.38 5.48 Favored 'Trans proline' 0 C--N 1.36 1.136 0 N-CA-C 108.453 -1.403 . . . . 0.0 108.453 176.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.11 105.02 14.65 Favored 'General case' 0 C--N 1.353 0.733 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -164.36 49.56 0.12 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 112.37 -2.195 . . . . 0.0 111.517 -178.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.22 133.63 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 113.948 -1.478 . . . . 0.0 107.549 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.622 0 CA-C-N 114.511 -1.222 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 ttt . . . . . 0 N--CA 1.443 -0.79 0 N-CA-C 104.394 -2.447 . . . . 0.0 104.394 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -96.15 149.24 21.85 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 104.301 -2.481 . . . . 0.0 104.301 -179.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.515 ' HB1' ' CD1' ' A' ' 53' ' ' ILE . . . -143.3 157.81 44.16 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 109.936 -3.302 . . . . 0.0 107.395 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.26 20.8 mt -147.19 116.19 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-N 111.963 -2.38 . . . . 0.0 109.305 -176.202 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.627 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -68.85 123.29 20.57 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 118.333 -1.347 . . . . 0.0 108.301 176.26 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -95.77 -23.56 16.9 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -141.16 163.32 33.28 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 125.355 1.659 . . . . 0.0 106.996 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -65.08 147.01 54.25 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 113.509 -1.678 . . . . 0.0 109.354 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -144.3 136.89 26.79 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 117.38 -1.728 . . . . 0.0 109.662 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -123.97 102.52 7.81 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 112.748 -2.024 . . . . 0.0 110.192 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.62 152.63 0.92 Allowed 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.381 1.086 . . . . 0.0 112.222 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.9 p -114.65 -14.42 12.05 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 111.464 -2.607 . . . . 0.0 114.306 -177.778 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -150.77 167.52 27.17 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-O 123.326 1.536 . . . . 0.0 110.049 -177.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -54.74 -30.48 56.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 110.018 -3.265 . . . . 0.0 113.907 -178.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 59.3 p30 -91.96 -2.8 56.57 Favored 'General case' 0 C--N 1.353 0.741 0 N-CA-C 114.857 1.429 . . . . 0.0 114.857 -177.571 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -108.84 156.01 20.14 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 125.012 1.445 . . . . 0.0 108.411 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.642 HD23 ' N ' ' A' ' 46' ' ' GLY . 0.3 OUTLIER -135.35 152.73 51.73 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 113.66 -1.609 . . . . 0.0 107.146 179.071 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.525 ' O ' HD12 ' A' ' 17' ' ' LEU . 25.0 m -83.0 166.69 18.6 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 112.805 -1.998 . . . . 0.0 113.636 -178.139 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -164.04 174.25 11.57 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-N 112.4 -2.182 . . . . 0.0 107.887 174.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 11.5 pttt -139.48 122.44 16.69 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 113.191 -1.822 . . . . 0.0 108.497 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -19.43 64.95 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 129.931 3.292 . . . . 0.0 118.29 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.627 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 158.87 -12.49 0.21 Allowed Glycine 0 CA--C 1.528 0.858 0 CA-C-N 112.452 -2.158 . . . . 0.0 114.622 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.417 ' HB3' HD21 ' A' ' 41' ' ' LEU . 41.7 m-20 -50.48 147.56 4.42 Favored 'General case' 0 C--N 1.36 1.041 0 CA-C-O 122.52 1.153 . . . . 0.0 113.414 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 70.1 mt -97.35 108.55 21.78 Favored 'Isoleucine or valine' 0 C--N 1.35 0.605 0 N-CA-C 101.618 -3.475 . . . . 0.0 101.618 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.507 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 0.5 OUTLIER -108.22 157.29 18.46 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 111.683 -2.508 . . . . 0.0 111.57 -176.413 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -106.9 103.82 13.34 Favored 'General case' 0 C--O 1.215 -0.717 0 CA-C-N 110.508 -3.042 . . . . 0.0 109.639 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.416 HG23 ' HB2' ' A' ' 3' ' ' ALA . 2.3 t -85.52 113.15 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 C-N-CA 116.71 -1.996 . . . . 0.0 106.663 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.404 HD23 ' H ' ' A' ' 29' ' ' ASN . 1.4 tp -91.72 -119.64 0.08 Allowed 'General case' 0 CA--C 1.553 1.08 0 CA-C-N 112.712 -2.04 . . . . 0.0 107.702 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.404 ' H ' HD23 ' A' ' 28' ' ' LEU . 2.1 t-20 -67.39 174.82 3.08 Favored 'General case' 0 C--N 1.355 0.844 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 177.67 49.86 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 112.596 -2.093 . . . . 0.0 110.642 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -85.39 111.97 20.42 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 112.506 -2.133 . . . . 0.0 109.34 -178.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 87.31 -48.57 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 110.964 -2.834 . . . . 0.0 114.978 175.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.0 p30 -57.58 147.29 27.53 Favored 'General case' 0 C--N 1.357 0.928 0 CA-C-O 122.568 1.175 . . . . 0.0 111.325 -178.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -141.39 54.95 1.53 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 112.69 -2.05 . . . . 0.0 107.804 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 -179.31 -15.01 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 111.844 -2.435 . . . . 0.0 113.287 -177.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -136.25 155.76 49.64 Favored 'General case' 0 C--N 1.351 0.673 0 O-C-N 124.15 0.906 . . . . 0.0 108.57 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -136.29 149.7 48.56 Favored 'General case' 0 C--N 1.351 0.663 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 176.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -98.25 120.6 38.93 Favored 'General case' 0 C--N 1.347 0.487 0 N-CA-C 102.101 -3.296 . . . . 0.0 102.101 177.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.99 172.61 12.6 Favored 'General case' 0 C--N 1.348 0.524 0 C-N-CA 118.074 -1.45 . . . . 0.0 112.062 -175.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -125.6 142.04 51.71 Favored 'General case' 0 C--N 1.356 0.861 0 CA-C-N 112.532 -2.122 . . . . 0.0 112.104 -177.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.444 ' HB2' HD11 ' A' ' 17' ' ' LEU . 4.2 mt -158.88 125.17 4.56 Favored 'General case' 0 C--O 1.222 -0.371 1 CA-C-N 108.337 -4.029 . . . . 0.0 115.041 -179.573 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.341 0.0 OUTLIER 61.06 28.98 18.67 Favored 'General case' 0 C--N 1.358 0.943 0 N-CA-C 119.557 3.169 . . . . 0.0 119.557 171.18 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 68.67 22.97 75.53 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 119.694 -1.241 . . . . 0.0 111.909 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -131.08 142.37 50.27 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 111.126 -2.537 . . . . 0.0 105.37 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -139.67 140.7 36.95 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 113.31 -1.768 . . . . 0.0 107.589 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.642 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -177.19 176.84 48.23 Favored Glycine 0 C--N 1.346 1.089 0 C-N-CA 118.651 -1.738 . . . . 0.0 111.901 -179.041 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -77.92 141.99 38.69 Favored 'General case' 0 C--N 1.35 0.606 0 CA-C-N 112.732 -1.734 . . . . 0.0 109.057 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 22.9 pt -142.12 148.17 47.2 Favored Pre-proline 0 N--CA 1.45 -0.454 0 CA-C-N 110.903 -2.862 . . . . 0.0 106.033 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -77.68 138.29 16.93 Favored 'Trans proline' 0 C--N 1.363 1.337 0 N-CA-C 114.066 0.756 . . . . 0.0 114.066 -177.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -33.51 71.89 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 117.315 -1.754 . . . . 0.0 112.549 -177.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.32 0.6 OUTLIER -70.01 -8.45 49.22 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 116.833 -1.947 . . . . 0.0 114.133 179.092 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.419 ' CE1' HG22 ' B' ' 5' ' ' VAL . 6.0 m-85 -93.01 -13.19 29.01 Favored 'General case' 0 CA--C 1.559 1.308 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 176.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.515 ' CD1' ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -128.88 170.62 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 CA-C-O 122.572 1.177 . . . . 0.0 109.736 179.606 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.491 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 2.8 tp10 -123.66 145.19 49.14 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 103.732 -2.692 . . . . 0.0 103.732 176.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . 0.275 38.5 mtm -85.17 -93.83 0.08 Allowed 'General case' 0 C--N 1.342 0.266 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -176.279 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm 71.05 94.46 0.05 OUTLIER Pre-proline 0 CA--C 1.563 1.461 0 CA-C-N 111.012 -2.813 . . . . 0.0 110.696 -176.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo . . . . . 0 CA--C 1.559 1.731 0 C-N-CA 121.769 1.646 . . . . 0.0 111.022 177.274 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.286 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' VAL . . . . . 0.431 HG13 ' O ' ' B' ' 1' ' ' VAL . 7.3 p -91.76 105.74 14.49 Favored Pre-proline 0 CA--C 1.539 0.557 0 O-C-N 126.234 2.209 . . . . 0.0 106.138 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -65.95 157.86 57.11 Favored 'Trans proline' 0 CA--C 1.554 1.495 0 N-CA-C 114.204 0.809 . . . . 0.0 114.204 177.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -54.71 160.94 6.63 Favored 'Trans proline' 0 C--N 1.368 1.575 0 C-N-CA 123.358 2.705 . . . . 0.0 116.997 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -73.51 127.93 12.23 Favored 'Trans proline' 0 C--N 1.371 1.757 0 N-CA-C 105.561 -2.515 . . . . 0.0 105.561 174.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.487 HG12 ' HD2' ' B' ' 6' ' ' PRO . 2.7 t -73.19 147.22 87.79 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-N 114.026 -1.443 . . . . 0.0 108.868 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 6' ' ' PRO . . . . . 0.487 ' HD2' HG12 ' B' ' 5' ' ' VAL . 13.4 Cg_exo -67.49 156.29 66.73 Favored 'Trans proline' 0 N--CA 1.45 -1.073 0 N-CA-C 115.69 1.381 . . . . 0.0 115.69 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -65.78 123.1 10.88 Favored 'Trans proline' 0 C--N 1.365 1.438 0 N-CA-C 107.347 -1.828 . . . . 0.0 107.347 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.84 84.74 2.04 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 122.989 1.376 . . . . 0.0 110.831 -177.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -174.35 66.47 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 112.152 -2.294 . . . . 0.0 109.727 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.273 0.1 OUTLIER -105.55 21.06 17.85 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 113.319 -1.764 . . . . 0.0 112.432 -179.222 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.344 0.345 0 CA-C-N 114.561 -1.2 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.448 -0.554 0 CA-C-O 122.471 1.129 . . . . 0.0 110.15 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -108.39 142.4 38.8 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 111.668 -2.515 . . . . 0.0 104.477 -179.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.608 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . -136.59 160.57 38.4 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 110.746 -2.934 . . . . 0.0 108.323 -176.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.251 44.3 mt -146.99 115.49 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.848 0 CA-C-N 109.931 -3.304 . . . . 0.0 109.423 -176.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.57 125.16 25.65 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 176.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.2 mtmt -95.45 -23.56 17.07 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 114.591 -1.186 . . . . 0.0 113.635 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -140.75 169.06 18.34 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 107.057 -1.46 . . . . 0.0 107.057 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -68.94 150.79 47.32 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.89 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -147.64 130.65 16.27 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 116.712 -1.995 . . . . 0.0 109.476 175.419 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.07 103.2 8.15 Favored 'General case' 0 CA--C 1.556 1.198 0 N-CA-C 106.088 -1.819 . . . . 0.0 106.088 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.82 154.38 0.33 Allowed 'General case' 0 C--N 1.375 1.696 0 O-C-N 124.717 1.261 . . . . 0.0 113.787 -178.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.0 p -111.66 -15.52 13.43 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-N 111.772 -2.467 . . . . 0.0 112.167 -177.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.42 163.12 40.16 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 123.123 1.439 . . . . 0.0 110.052 -178.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -51.71 -34.24 37.93 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 110.733 -2.94 . . . . 0.0 115.263 -176.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -89.1 0.1 56.99 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 118.383 -1.327 . . . . 0.0 114.501 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.06 159.5 16.25 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 113.013 -1.903 . . . . 0.0 106.236 176.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.562 HD12 ' O ' ' A' ' 18' ' ' SER . 0.4 OUTLIER -136.68 155.41 49.91 Favored 'General case' 0 CA--C 1.562 1.428 0 C-N-CA 118.303 -1.359 . . . . 0.0 108.049 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.562 ' O ' HD12 ' A' ' 17' ' ' LEU . 15.8 m -83.67 163.78 20.08 Favored 'General case' 0 CA--C 1.568 1.645 0 CA-C-N 113.419 -1.719 . . . . 0.0 113.021 -177.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -164.71 172.7 12.73 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 111.074 -2.785 . . . . 0.0 107.457 173.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -132.65 151.64 51.9 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 104.621 -2.363 . . . . 0.0 104.621 178.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.5 ttp180 -46.89 104.48 0.05 Allowed 'General case' 0 CA--C 1.556 1.173 0 CA-C-N 112.994 -1.912 . . . . 0.0 112.381 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.32 -23.22 4.61 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-N 113.446 -1.706 . . . . 0.0 115.743 178.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.405 ' HB3' HD21 ' A' ' 41' ' ' LEU . 47.8 m-20 -48.57 147.65 2.4 Favored 'General case' 0 C--N 1.364 1.239 0 N-CA-C 116.274 1.953 . . . . 0.0 116.274 -177.055 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.2 mp -100.87 117.05 45.55 Favored 'Isoleucine or valine' 0 C--N 1.346 0.416 0 CA-C-N 111.772 -2.467 . . . . 0.0 104.922 176.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.693 HD22 HD13 ' A' ' 48' ' ' ILE . 4.6 mp -110.67 159.88 17.19 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 122.748 1.261 . . . . 0.0 112.707 -179.035 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.0 108.14 19.2 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-N 110.78 -2.918 . . . . 0.0 105.633 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.454 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 2.7 t -87.13 102.3 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 111.827 -3.949 . . . . 0.0 110.147 -174.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.9 tt -91.34 97.18 10.94 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 117.4 -1.72 . . . . 0.0 106.904 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.6 m120 69.11 154.47 0.12 Allowed 'General case' 0 CA--C 1.55 0.956 0 CA-C-N 112.962 -1.927 . . . . 0.0 110.923 -178.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -166.87 59.58 0.09 Allowed 'General case' 0 CA--C 1.557 1.229 0 CA-C-N 111.436 -2.62 . . . . 0.0 112.927 -177.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -125.97 -28.36 3.19 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 118.107 2.632 . . . . 0.0 118.107 -178.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.9 t -70.41 -8.75 53.22 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 109.972 -3.286 . . . . 0.0 116.184 -175.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -167.1 129.54 1.72 Allowed 'General case' 0 C--N 1.349 0.57 0 CA-C-O 122.759 1.266 . . . . 0.0 109.983 -177.417 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -72.35 -31.01 65.25 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 112.853 -1.976 . . . . 0.0 115.314 -176.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.458 ' HA ' ' HG2' ' A' ' 50' ' ' LYS . 32.1 m-20 -96.7 -18.52 19.61 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 131.62 3.968 . . . . 0.0 112.845 -174.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -123.38 152.87 41.1 Favored 'General case' 0 CA--C 1.553 1.074 0 O-C-N 124.338 1.024 . . . . 0.0 109.389 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -134.21 144.64 48.57 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 104.992 -2.225 . . . . 0.0 104.992 177.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -101.18 124.7 47.29 Favored 'General case' 0 C--N 1.358 0.948 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 178.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -144.34 169.14 18.49 Favored 'General case' 0 C--N 1.357 0.911 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -109.6 136.16 49.42 Favored 'General case' 0 C--N 1.367 1.342 0 CA-C-N 113.79 -1.55 . . . . 0.0 111.338 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.533 ' HB2' HD11 ' A' ' 17' ' ' LEU 0.304 11.2 mt -162.49 139.76 8.12 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 110.297 -3.138 . . . . 0.0 113.577 177.575 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 58.39 28.94 17.52 Favored 'General case' 0 C--N 1.353 0.737 0 CA-C-N 110.829 -2.896 . . . . 0.0 115.48 169.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.07 18.19 78.87 Favored Glycine 0 CA--C 1.541 1.698 0 CA-C-N 114.647 -1.16 . . . . 0.0 114.199 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -137.37 166.56 23.52 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 124.593 1.157 . . . . 0.0 107.937 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -142.68 136.49 29.09 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 112.33 -2.214 . . . . 0.0 106.423 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.53 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -174.14 175.36 46.6 Favored Glycine 0 C--N 1.347 1.154 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.144 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -78.78 147.83 33.17 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 122.927 1.346 . . . . 0.0 110.25 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.693 HD13 HD22 ' A' ' 25' ' ' LEU . 9.0 pt -142.16 147.85 45.72 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-N 111.54 -2.573 . . . . 0.0 106.162 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -75.41 142.43 26.64 Favored 'Trans proline' 0 C--N 1.362 1.275 0 N-CA-C 114.498 0.922 . . . . 0.0 114.498 -177.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.458 ' HG2' ' HA ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -70.53 -30.92 67.79 Favored 'General case' 0 C--N 1.369 1.425 0 C-N-CA 113.345 -3.342 . . . . 0.0 113.493 -179.719 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -69.49 -9.54 54.2 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 116.161 -2.216 . . . . 0.0 114.726 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.43 ' CE1' HG22 ' B' ' 5' ' ' VAL . 7.5 m-85 -93.04 -12.0 31.67 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.346 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.608 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -128.62 171.66 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 178.359 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.482 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 85.5 tt0 -132.19 132.96 43.65 Favored 'General case' 0 C--N 1.355 0.817 0 CA-C-N 112.53 -2.123 . . . . 0.0 106.16 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -85.05 168.89 14.49 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 113.369 -1.741 . . . . 0.0 110.004 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -153.37 83.77 4.47 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 112.046 -2.343 . . . . 0.0 109.637 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo . . . . . 0 C--N 1.37 1.678 0 C-N-CA 121.914 1.743 . . . . 0.0 108.878 176.197 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.334 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 6.0 m -68.82 116.58 42.63 Favored Pre-proline 0 N--CA 1.433 -1.313 0 O-C-N 125.238 1.586 . . . . 0.0 109.442 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 2' ' ' PRO . . . . . 0.431 ' HA ' ' HD3' ' B' ' 3' ' ' PRO . 2.8 Cg_endo -69.52 154.42 68.7 Favored 'Trans proline' 0 N--CA 1.431 -2.156 0 N-CA-C 115.402 1.27 . . . . 0.0 115.402 178.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' B' ' 2' ' ' PRO . 38.5 Cg_exo -54.81 156.75 14.3 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.663 2.242 . . . . 0.0 117.03 179.065 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -69.54 123.45 10.18 Favored 'Trans proline' 0 C--N 1.365 1.407 0 N-CA-C 105.345 -2.598 . . . . 0.0 105.345 174.026 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.484 HG12 ' HD2' ' B' ' 6' ' ' PRO . 3.3 t -72.05 150.39 92.47 Favored Pre-proline 0 C--N 1.343 0.296 0 CA-C-N 113.619 -1.628 . . . . 0.0 108.665 -178.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' PRO . . . . . 0.484 ' HD2' HG12 ' B' ' 5' ' ' VAL . 19.5 Cg_exo -69.99 155.87 64.13 Favored 'Trans proline' 0 N--CA 1.445 -1.328 0 O-C-N 123.473 1.249 . . . . 0.0 112.297 176.238 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -72.52 118.29 5.52 Favored 'Trans proline' 0 CA--C 1.547 1.16 0 N-CA-C 107.253 -1.864 . . . . 0.0 107.253 175.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.05 162.23 20.42 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 178.692 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 116.76 63.94 0.0 OUTLIER 'General case' 0 C--N 1.355 0.832 0 C-N-CA 130.735 3.614 . . . . 0.0 108.22 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -170.11 142.98 2.38 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.261 -1.336 . . . . 0.0 107.44 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.305 0 CA-C-N 113.978 -1.464 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.222 -0.363 0 N-CA-C 106.387 -1.708 . . . . 0.0 106.387 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.637 ' O ' HG23 ' A' ' 27' ' ' VAL 0.278 1.2 mm-40 -89.89 -81.32 0.29 Allowed 'General case' 0 CA--C 1.555 1.138 0 CA-C-O 123.835 1.779 . . . . 0.0 112.708 -178.469 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.897 ' HB1' HD11 ' A' ' 53' ' ' ILE . . . 80.53 167.23 0.16 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 109.346 -3.57 . . . . 0.0 110.191 -176.631 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.428 12.0 mt -149.61 130.81 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 111.336 -2.665 . . . . 0.0 111.949 -167.461 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.467 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -65.84 126.3 28.08 Favored 'General case' 0 CA--C 1.556 1.174 0 CA-C-N 113.589 -1.641 . . . . 0.0 108.742 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mmpt? -98.02 -28.03 13.96 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 114.047 -1.433 . . . . 0.0 114.155 -178.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.412 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 22.1 m-85 -141.38 166.05 25.82 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 106.168 -1.79 . . . . 0.0 106.168 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.88 147.8 52.76 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 124.338 1.024 . . . . 0.0 109.451 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -146.69 132.78 19.28 Favored 'General case' 0 C--N 1.354 0.798 0 C-N-CA 118.043 -1.463 . . . . 0.0 109.471 176.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.9 mmtm -122.29 113.07 18.92 Favored 'General case' 0 C--N 1.346 0.431 0 CA-C-N 113.712 -1.585 . . . . 0.0 107.603 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.03 149.98 0.84 Allowed 'General case' 0 C--N 1.359 1.01 0 O-C-N 125.639 1.837 . . . . 0.0 112.468 -177.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.4 p -113.68 -19.4 11.59 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 111.054 -2.794 . . . . 0.0 113.557 -177.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.81 167.79 27.87 Favored 'General case' 0 C--N 1.354 0.777 0 CA-C-O 123.776 1.751 . . . . 0.0 111.965 -178.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -43.02 -39.67 2.75 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 109.824 -3.353 . . . . 0.0 115.393 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 49.2 p-10 -87.74 -0.81 57.41 Favored 'General case' 0 C--N 1.349 0.573 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 -175.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -106.39 159.77 15.89 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.714 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.626 HD11 ' HB2' ' A' ' 41' ' ' LEU . 0.5 OUTLIER -129.06 150.5 50.44 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 112.017 -2.356 . . . . 0.0 106.213 179.513 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.551 ' O ' HD12 ' A' ' 17' ' ' LEU . 10.2 m -84.07 169.1 15.26 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 123.709 1.718 . . . . 0.0 113.721 -177.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -162.69 178.99 8.02 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-N 111.712 -2.495 . . . . 0.0 108.377 171.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt -139.33 135.18 33.5 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 103.836 -2.653 . . . . 0.0 103.836 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -42.28 97.95 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.779 0 O-C-N 125.555 1.784 . . . . 0.0 113.489 -177.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.467 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 138.31 -22.81 3.04 Favored Glycine 0 C--N 1.35 1.344 0 CA-C-N 113.209 -1.814 . . . . 0.0 115.33 178.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.619 ' HB3' HD21 ' A' ' 41' ' ' LEU . 4.4 m-20 -47.02 143.3 3.08 Favored 'General case' 0 C--N 1.364 1.214 0 CA-C-O 121.547 0.689 . . . . 0.0 112.049 -179.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mt -96.87 124.96 49.95 Favored 'Isoleucine or valine' 0 C--N 1.35 0.611 0 N-CA-C 103.498 -2.778 . . . . 0.0 103.498 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.485 HD22 ' CD1' ' A' ' 48' ' ' ILE . 0.8 OUTLIER -111.07 157.8 19.57 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 125.201 1.563 . . . . 0.0 111.711 -175.685 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -118.99 103.26 9.41 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 128.74 3.775 . . . . 0.0 108.605 176.041 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.637 HG23 ' O ' ' A' ' 2' ' ' GLU . 23.5 t -85.19 103.33 12.17 Favored 'Isoleucine or valine' 0 C--N 1.353 0.759 0 C-N-CA 116.139 -2.224 . . . . 0.0 109.744 -176.299 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 28' ' ' LEU . 0.8 OUTLIER -92.85 96.99 10.47 Favored 'General case' 0 C--N 1.355 0.806 0 CA-C-N 112.826 -1.988 . . . . 0.0 105.89 177.742 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.3 t30 71.72 161.49 0.24 Allowed 'General case' 0 CA--C 1.558 1.27 0 CA-C-N 113.235 -1.802 . . . . 0.0 111.808 -179.056 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -168.46 96.0 0.39 Allowed 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 111.441 -2.618 . . . . 0.0 106.425 -178.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -174.33 58.3 0.02 OUTLIER 'General case' 0 C--N 1.347 0.494 0 CA-C-O 123.768 1.747 . . . . 0.0 108.12 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.7 t -121.71 -65.99 1.08 Allowed 'General case' 0 C--O 1.222 -0.344 0 CA-C-N 110.293 -3.14 . . . . 0.0 108.129 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -161.0 120.54 2.63 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-N 113.635 -1.62 . . . . 0.0 106.952 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.4 pm0 -62.88 109.63 1.51 Allowed 'General case' 0 C--N 1.355 0.805 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 -178.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 147.13 -16.59 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 128.513 2.725 . . . . 0.0 112.876 -174.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 55.6 m95 -135.85 164.01 28.91 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -178.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -137.47 145.9 43.63 Favored 'General case' 0 C--N 1.358 0.936 0 O-C-N 124.392 1.058 . . . . 0.0 109.198 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.73 115.23 30.08 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 176.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.75 172.12 13.24 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 118.936 -1.106 . . . . 0.0 112.225 -176.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -108.79 130.35 55.39 Favored 'General case' 0 C--N 1.357 0.902 0 CA-C-N 113.566 -1.652 . . . . 0.0 111.789 -178.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.626 ' HB2' HD11 ' A' ' 17' ' ' LEU 0.274 13.6 mt -163.15 146.29 10.57 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-N 110.409 -3.087 . . . . 0.0 115.501 178.131 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 57.35 29.03 16.19 Favored 'General case' 0 C--N 1.358 0.969 0 CA-C-N 111.374 -2.648 . . . . 0.0 114.929 169.299 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 71.83 21.15 79.03 Favored Glycine 0 CA--C 1.542 1.757 0 O-C-N 124.433 1.083 . . . . 0.0 114.679 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -138.16 169.59 17.52 Favored 'General case' 0 C--N 1.35 0.606 0 C-N-CA 125.532 1.533 . . . . 0.0 108.45 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -142.27 131.19 22.99 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 112.439 -2.164 . . . . 0.0 105.921 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.582 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -174.91 -179.22 45.35 Favored Glycine 0 C--N 1.344 1.023 0 C-N-CA 118.091 -2.004 . . . . 0.0 112.787 -178.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -78.17 145.04 35.86 Favored 'General case' 0 C--N 1.353 0.734 0 CA-C-N 113.445 -1.378 . . . . 0.0 111.475 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.485 ' CD1' HD22 ' A' ' 25' ' ' LEU . 27.0 pt -144.86 148.13 37.9 Favored Pre-proline 0 C--N 1.351 0.634 0 CA-C-N 112.362 -2.199 . . . . 0.0 108.465 178.269 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.44 ' HB3' ' HD2' ' B' ' 6' ' ' PRO . 11.6 Cg_endo -78.42 140.74 17.38 Favored 'Trans proline' 0 C--N 1.366 1.498 0 CA-C-N 119.472 0.847 . . . . 0.0 114.289 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.3 ptmm? -70.54 -35.57 73.2 Favored 'General case' 0 C--N 1.362 1.125 0 C-N-CA 116.344 -2.142 . . . . 0.0 113.106 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.268 0.7 OUTLIER -66.76 -9.86 41.2 Favored 'General case' 0 C--N 1.364 1.209 0 C-N-CA 114.276 -2.969 . . . . 0.0 114.57 -179.525 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -92.45 -12.6 31.66 Favored 'General case' 0 C--N 1.359 0.983 0 CA-C-O 117.446 -1.264 . . . . 0.0 111.589 178.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.897 HD11 ' HB1' ' A' ' 3' ' ' ALA . 0.0 OUTLIER -135.52 155.12 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 CA-C-N 119.07 0.85 . . . . 0.0 110.466 178.045 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.511 ' N ' HG12 ' A' ' 53' ' ' ILE . 40.8 tt0 -115.46 146.62 41.48 Favored 'General case' 0 C--N 1.361 1.069 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 177.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -85.26 159.52 20.05 Favored 'General case' 0 C--N 1.346 0.438 0 CA-C-N 113.157 -1.838 . . . . 0.0 111.91 -178.002 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 21.2 mmtt -151.27 83.53 5.48 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 112.769 -2.014 . . . . 0.0 108.872 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo . . . . . 0 C--N 1.369 1.608 0 C-N-CA 122.011 1.807 . . . . 0.0 108.435 176.277 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.278 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 96.6 t -97.35 108.62 45.74 Favored Pre-proline 0 C--N 1.349 0.576 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 2' ' ' PRO . . . . . 0.412 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 7.5 Cg_exo -62.75 159.71 36.14 Favored 'Trans proline' 0 CA--C 1.551 1.331 0 O-C-N 123.16 1.084 . . . . 0.0 114.155 178.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -54.18 158.71 8.92 Favored 'Trans proline' 0 C--N 1.358 1.07 0 N-CA-C 117.1 1.923 . . . . 0.0 117.1 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_endo -70.65 123.3 9.68 Favored 'Trans proline' 0 C--N 1.36 1.163 0 N-CA-C 104.91 -2.765 . . . . 0.0 104.91 173.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.507 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.3 t -63.81 148.39 94.72 Favored Pre-proline 0 C--N 1.35 0.625 0 O-C-N 124.84 1.338 . . . . 0.0 109.205 -178.022 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 6' ' ' PRO . . . . . 0.507 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 23.2 Cg_exo -62.61 153.48 71.46 Favored 'Trans proline' 0 N--CA 1.447 -1.221 0 O-C-N 122.93 0.963 . . . . 0.0 114.253 178.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -69.62 112.8 3.15 Favored 'Trans proline' 0 C--N 1.363 1.338 0 N-CA-C 106.648 -2.097 . . . . 0.0 106.648 176.115 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.25 148.94 24.1 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-N 113.009 -1.905 . . . . 0.0 106.702 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 72.26 70.38 0.15 Allowed 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.62 1.2 . . . . 0.0 109.117 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -16.24 89.65 0.01 OUTLIER 'General case' 0 C--N 1.36 1.024 0 C-N-CA 127.634 2.373 . . . . 0.0 112.775 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.067 0 CA-C-N 112.835 -1.984 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.159 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -107.04 -5.65 17.95 Favored 'General case' 0 C--N 1.354 0.767 0 O-C-N 125.669 1.856 . . . . 0.0 115.56 -176.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.473 ' HB3' ' H ' ' A' ' 25' ' ' LEU . . . 51.31 -172.86 0.02 OUTLIER 'General case' 0 C--O 1.221 -0.398 0 CA-C-O 123.326 1.536 . . . . 0.0 113.881 178.169 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.454 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 2.0 mt -157.42 -177.3 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 100.425 -3.917 . . . . 0.0 100.425 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -165.82 108.87 0.79 Allowed 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 102.389 -3.189 . . . . 0.0 102.389 177.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.9 mtmp? -90.01 -15.19 32.39 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 111.122 -2.763 . . . . 0.0 116.504 -175.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.439 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 32.8 m-85 -142.35 164.79 29.19 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 179.151 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -71.37 152.88 42.75 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 117.17 -1.812 . . . . 0.0 108.419 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -142.68 142.69 32.08 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.5 tptt -134.83 103.79 5.75 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 112.548 -2.115 . . . . 0.0 108.164 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.25 158.6 0.1 Allowed 'General case' 0 N--CA 1.482 1.15 0 CA-C-O 122.944 1.354 . . . . 0.0 114.199 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.0 p -119.09 -15.28 9.26 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 110.335 -3.121 . . . . 0.0 112.669 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.16 170.08 21.4 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-O 123.316 1.531 . . . . 0.0 113.366 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -50.63 -34.79 27.56 Favored 'General case' 0 CA--C 1.555 1.159 0 CA-C-N 109.948 -3.296 . . . . 0.0 114.337 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -92.19 -5.0 53.38 Favored 'General case' 0 C--N 1.355 0.828 0 N-CA-C 115.551 1.686 . . . . 0.0 115.551 -176.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -108.86 156.5 19.59 Favored 'General case' 0 C--O 1.222 -0.377 0 O-C-N 124.826 1.329 . . . . 0.0 108.936 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.444 HD23 ' C ' ' A' ' 45' ' ' ASP 0.265 2.9 pp -137.79 156.04 48.38 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 112.718 -2.037 . . . . 0.0 111.121 177.831 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 m -84.42 170.54 13.45 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 111.913 -2.403 . . . . 0.0 115.484 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -163.53 175.56 10.58 Favored 'General case' 0 C--N 1.352 0.699 0 CA-C-N 109.461 -3.518 . . . . 0.0 107.586 175.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mtmt -136.53 143.18 43.58 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 112.777 -2.01 . . . . 0.0 106.388 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -44.08 98.05 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.28 0 O-C-N 126.247 2.217 . . . . 0.0 112.957 -178.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 140.34 -23.24 2.71 Favored Glycine 0 CA--C 1.543 1.81 0 CA-C-N 113.428 -1.714 . . . . 0.0 114.992 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -51.22 145.84 7.48 Favored 'General case' 0 C--N 1.363 1.154 0 N-CA-C 116.099 1.888 . . . . 0.0 116.099 -176.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -104.34 112.77 39.24 Favored 'Isoleucine or valine' 0 C--N 1.346 0.456 0 N-CA-C 102.188 -3.264 . . . . 0.0 102.188 173.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.565 HD22 HD13 ' A' ' 48' ' ' ILE . 6.3 mp -104.95 167.76 9.5 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 116.146 -2.222 . . . . 0.0 112.923 -176.182 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.72 109.15 20.97 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 176.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.402 HG23 ' HB2' ' A' ' 3' ' ' ALA . 71.1 t -87.78 97.02 6.19 Favored 'Isoleucine or valine' 0 C--N 1.357 0.927 0 C-N-CA 114.888 -2.725 . . . . 0.0 107.874 -177.21 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -93.15 98.53 11.36 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 111.955 -2.384 . . . . 0.0 107.484 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.9 m120 66.99 147.98 0.05 OUTLIER 'General case' 0 CA--C 1.561 1.385 0 CA-C-N 112.636 -2.075 . . . . 0.0 111.82 -179.058 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -150.95 91.03 1.66 Allowed 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 110.875 -2.875 . . . . 0.0 108.912 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -169.78 92.86 0.24 Allowed 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 9.0 p -175.91 -46.18 0.01 OUTLIER 'General case' 0 C--N 1.352 0.687 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.911 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -160.66 110.83 1.76 Allowed 'General case' 0 C--N 1.359 0.999 0 C-N-CA 119.047 -1.061 . . . . 0.0 109.618 -178.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -64.46 108.77 1.74 Allowed 'General case' 0 C--N 1.355 0.827 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.4 m120 142.04 -14.43 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.589 0 O-C-N 126.981 2.675 . . . . 0.0 109.913 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.5 m95 -136.49 161.31 36.21 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.776 0.798 . . . . 0.0 110.85 -177.381 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -133.71 150.92 51.52 Favored 'General case' 0 C--N 1.355 0.819 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.7 tttt -102.68 119.16 38.35 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 176.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.0 170.11 16.34 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 118.273 -1.371 . . . . 0.0 113.401 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -110.57 138.55 46.82 Favored 'General case' 0 C--N 1.362 1.116 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.64 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.507 HD11 HD21 ' A' ' 25' ' ' LEU 0.281 12.1 mt -160.02 138.24 10.19 Favored 'General case' 0 CA--C 1.502 -0.88 0 CA-C-N 112.709 -2.041 . . . . 0.0 112.977 179.131 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 56.92 21.9 6.62 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 116.191 -2.203 . . . . 0.0 115.658 168.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 92.51 -9.06 76.58 Favored Glycine 0 CA--C 1.546 1.988 0 N-CA-C 115.37 0.908 . . . . 0.0 115.37 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.9 mttp -113.25 170.05 8.5 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.444 ' C ' HD23 ' A' ' 17' ' ' LEU . 19.9 t70 -140.94 131.17 24.92 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 113.119 -1.855 . . . . 0.0 106.303 -179.06 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.96 173.37 45.57 Favored Glycine 0 C--N 1.349 1.267 0 C-N-CA 116.401 -2.809 . . . . 0.0 113.217 -177.507 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -76.77 139.34 40.37 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 123.653 1.692 . . . . 0.0 109.511 -179.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.565 HD13 HD22 ' A' ' 25' ' ' LEU . 1.0 OUTLIER -139.99 143.1 32.93 Favored Pre-proline 0 C--N 1.347 0.498 0 CA-C-N 110.8 -2.909 . . . . 0.0 106.462 179.471 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -74.76 143.75 30.31 Favored 'Trans proline' 0 C--N 1.361 1.216 0 N-CA-C 115.07 1.142 . . . . 0.0 115.07 -175.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 15.6 pttt -71.9 -33.85 68.65 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 116.072 -2.251 . . . . 0.0 113.947 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -62.11 -19.66 63.23 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-N 115.077 -0.965 . . . . 0.0 113.144 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -93.35 -13.34 28.22 Favored 'General case' 0 CA--C 1.566 1.591 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.502 HG21 ' CD1' ' A' ' 48' ' ' ILE . 0.1 OUTLIER -126.86 173.25 12.79 Favored 'Isoleucine or valine' 0 C--N 1.368 1.401 0 CA-C-O 121.808 0.813 . . . . 0.0 111.115 -178.338 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.494 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 0.2 OUTLIER -131.41 137.15 48.55 Favored 'General case' 0 C--N 1.358 0.971 0 CA-C-N 112.691 -2.05 . . . . 0.0 107.494 178.163 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 62.2 mtm -84.57 157.83 21.1 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 20.7 mmtp -152.12 95.14 3.2 Favored Pre-proline 0 CA--C 1.545 0.765 0 CA-C-N 113.961 -1.472 . . . . 0.0 111.915 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 C--N 1.372 1.774 0 C-N-CA 122.001 1.8 . . . . 0.0 112.095 176.538 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.304 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 74.5 t -122.4 93.34 48.56 Favored Pre-proline 0 C--N 1.346 0.427 0 O-C-N 125.218 1.574 . . . . 0.0 106.895 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' PRO . . . . . 0.439 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 5.0 Cg_exo -64.39 159.95 41.54 Favored 'Trans proline' 0 CA--C 1.573 2.431 0 N-CA-C 116.069 1.527 . . . . 0.0 116.069 177.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -52.6 156.35 8.87 Favored 'Trans proline' 0 C--N 1.373 1.831 0 C-N-CA 123.953 3.102 . . . . 0.0 116.785 178.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -74.67 120.34 6.12 Favored 'Trans proline' 0 C--N 1.358 1.037 0 N-CA-C 106.287 -2.236 . . . . 0.0 106.287 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.477 HG12 ' HD2' ' B' ' 6' ' ' PRO . 2.5 t -66.02 149.95 97.14 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-N 113.555 -1.657 . . . . 0.0 109.908 -178.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 6' ' ' PRO . . . . . 0.477 ' HD2' HG12 ' B' ' 5' ' ' VAL . 15.7 Cg_exo -71.26 159.95 50.35 Favored 'Trans proline' 0 C--N 1.359 1.099 0 N-CA-C 116.749 1.788 . . . . 0.0 116.749 178.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -75.94 118.69 5.11 Favored 'Trans proline' 0 C--N 1.359 1.098 0 N-CA-C 107.157 -1.901 . . . . 0.0 107.157 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.497 ' H ' ' NE ' ' B' ' 8' ' ' ARG . 0.0 OUTLIER -98.32 156.58 16.66 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 178.22 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 71.31 69.69 0.17 Allowed 'General case' 0 C--N 1.345 0.406 0 CA-C-N 112.02 -2.354 . . . . 0.0 108.624 -178.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 42.6 mmm-85 3.2 79.17 0.0 OUTLIER 'General case' 0 C--N 1.354 0.766 0 C-N-CA 129.491 3.116 . . . . 0.0 113.324 178.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.097 0 CA-C-N 110.054 -3.248 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -111.36 148.68 32.47 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 111.976 -2.375 . . . . 0.0 106.199 -177.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.638 ' HB1' ' CD1' ' A' ' 53' ' ' ILE . . . -138.51 170.56 15.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 111.587 -2.551 . . . . 0.0 109.648 -179.227 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.452 ' H ' HG13 ' A' ' 53' ' ' ILE . 11.1 mt -156.63 110.02 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.806 0 CA-C-N 111.286 -2.688 . . . . 0.0 109.408 -176.576 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.573 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -68.17 122.13 17.64 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 116.073 -2.251 . . . . 0.0 109.375 178.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -96.16 -23.01 16.94 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -179.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.553 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 17.6 m-85 -140.01 160.57 39.64 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.2 151.22 47.93 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.042 -1.435 . . . . 0.0 109.561 -178.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -143.77 139.3 29.33 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 176.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? -126.45 96.88 4.83 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-N 111.964 -2.38 . . . . 0.0 109.677 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -45.22 149.51 0.5 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 122.192 0.996 . . . . 0.0 113.387 -178.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.8 t -123.92 2.32 8.72 Favored 'General case' 0 C--N 1.354 0.772 0 CA-C-N 111.309 -2.678 . . . . 0.0 114.855 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.4 163.84 39.21 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 118.399 -1.32 . . . . 0.0 110.363 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -50.6 -39.17 49.23 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-N 111.609 -2.541 . . . . 0.0 113.264 -178.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.6 p30 -88.9 1.07 55.97 Favored 'General case' 0 C--N 1.354 0.778 0 N-CA-C 116.421 2.008 . . . . 0.0 116.421 -176.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -113.66 153.14 29.42 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 124.633 1.208 . . . . 0.0 109.382 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.627 HD23 ' N ' ' A' ' 46' ' ' GLY . 0.6 OUTLIER -136.39 158.76 43.66 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 113.47 -1.695 . . . . 0.0 110.793 178.476 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.531 ' O ' HD12 ' A' ' 17' ' ' LEU . 15.7 m -84.2 170.83 13.36 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 116.933 2.197 . . . . 0.0 116.933 -177.41 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -163.83 170.55 16.7 Favored 'General case' 0 C--N 1.355 0.824 0 CA-C-N 109.07 -3.695 . . . . 0.0 109.863 176.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -135.45 118.29 16.2 Favored 'General case' 0 C--N 1.354 0.787 0 CA-C-N 112.57 -2.105 . . . . 0.0 110.57 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -14.51 74.48 0.0 OUTLIER 'General case' 0 CA--C 1.559 1.291 0 N-CA-C 116.837 2.162 . . . . 0.0 116.837 178.149 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.573 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 150.78 -16.74 0.94 Allowed Glycine 0 CA--C 1.537 1.427 0 CA-C-N 111.847 -2.433 . . . . 0.0 116.0 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.587 ' HB3' HD21 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -50.96 151.59 2.5 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -178.531 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.3 pt -98.71 108.68 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.393 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.621 HD22 HD13 ' A' ' 48' ' ' ILE . 3.0 mp -104.75 157.36 17.25 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 116.443 -2.103 . . . . 0.0 110.804 -177.287 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -105.0 106.54 17.07 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 110.922 -2.854 . . . . 0.0 108.026 177.399 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 86.6 t -86.7 111.08 21.01 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 C-N-CA 115.216 -2.594 . . . . 0.0 106.099 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.742 ' O ' HD13 ' A' ' 28' ' ' LEU . 3.4 tm? -96.22 -16.16 21.59 Favored 'General case' 0 C--N 1.352 0.708 0 CA-C-N 112.592 -2.095 . . . . 0.0 113.844 -176.466 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -168.33 112.0 0.6 Allowed 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 115.599 -2.441 . . . . 0.0 113.052 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -97.49 176.8 5.73 Favored 'General case' 0 C--N 1.356 0.856 0 CA-C-N 114.2 -1.364 . . . . 0.0 108.619 177.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 67.62 81.43 0.19 Allowed 'General case' 0 C--N 1.359 1.002 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 42.5 t -166.63 -29.71 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 112.972 -1.922 . . . . 0.0 112.267 179.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -172.96 69.79 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 178.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -31.7 78.96 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 131.284 3.834 . . . . 0.0 111.115 -177.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.406 ' HA ' ' CD ' ' A' ' 50' ' ' LYS . 22.3 m-20 156.76 -0.83 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.441 0 O-C-N 127.238 2.836 . . . . 0.0 112.565 -176.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -135.39 169.58 17.27 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 122.357 1.075 . . . . 0.0 109.66 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -137.97 139.62 39.8 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 113.235 -1.802 . . . . 0.0 106.715 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -98.76 115.52 28.94 Favored 'General case' 0 C--N 1.354 0.772 0 N-CA-C 100.393 -3.928 . . . . 0.0 100.393 176.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.49 176.23 8.89 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 125.044 1.465 . . . . 0.0 113.417 -173.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -120.02 148.32 43.71 Favored 'General case' 0 C--N 1.362 1.12 0 O-C-N 125.064 1.478 . . . . 0.0 111.118 -179.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.587 HD21 ' HB3' ' A' ' 23' ' ' ASP 0.302 9.4 mt -161.94 138.93 8.33 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-N 110.465 -3.061 . . . . 0.0 111.953 179.342 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.63 29.06 12.92 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 115.688 -2.405 . . . . 0.0 116.43 168.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.94 10.63 85.42 Favored Glycine 0 CA--C 1.546 2.019 0 C-N-CA 118.662 -1.732 . . . . 0.0 115.013 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -135.73 163.01 31.15 Favored 'General case' 0 C--O 1.217 -0.629 0 C-N-CA 124.597 1.159 . . . . 0.0 107.942 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -141.41 139.73 33.51 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.419 -178.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.627 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -170.96 176.09 44.46 Favored Glycine 0 C--N 1.347 1.161 0 C-N-CA 118.477 -1.82 . . . . 0.0 110.591 -177.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -77.3 144.8 37.83 Favored 'General case' 0 C--N 1.354 0.801 0 CA-C-O 122.522 1.153 . . . . 0.0 110.708 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.621 HD13 HD22 ' A' ' 25' ' ' LEU . 1.3 pt -144.42 139.29 15.48 Favored Pre-proline 0 C--N 1.352 0.677 0 CA-C-N 112.392 -2.185 . . . . 0.0 107.819 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -72.02 148.66 51.38 Favored 'Trans proline' 0 C--N 1.363 1.336 0 CA-C-N 120.018 1.042 . . . . 0.0 114.197 -176.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.406 ' CD ' ' HA ' ' A' ' 35' ' ' ASN . 18.6 ptmt -70.22 -41.69 73.29 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 115.136 -2.626 . . . . 0.0 111.395 -178.422 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.405 HD22 ' HB2' ' B' ' 3' ' ' PRO . 13.1 p-10 -57.46 -18.68 19.65 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.421 ' CE1' HG22 ' B' ' 5' ' ' VAL . 6.9 m-85 -91.63 -7.81 48.98 Favored 'General case' 0 C--N 1.355 0.843 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.191 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.638 ' CD1' ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -129.83 172.8 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.1 0 CA-C-O 122.184 0.992 . . . . 0.0 108.759 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.438 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 21.7 tt0 -129.47 131.74 46.76 Favored 'General case' 0 C--N 1.349 0.568 0 N-CA-C 104.756 -2.312 . . . . 0.0 104.756 176.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -86.74 170.81 11.43 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 113.556 -1.656 . . . . 0.0 110.599 178.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.4 mtmm -156.53 97.62 2.16 Favored Pre-proline 0 N--CA 1.447 -0.611 0 CA-C-N 110.904 -2.862 . . . . 0.0 105.771 178.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo . . . . . 0 CA--C 1.55 1.276 0 O-C-N 123.565 1.298 . . . . 0.0 114.609 -179.297 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.401 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 47.2 t 31.56 91.57 0.05 OUTLIER Pre-proline 0 C--N 1.351 0.654 0 C-N-CA 127.485 2.314 . . . . 0.0 110.631 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 2' ' ' PRO . . . . . 0.553 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 2.7 Cg_endo -65.9 157.05 61.21 Favored 'Trans proline' 0 CA--C 1.579 2.73 0 N-CA-C 116.01 1.504 . . . . 0.0 116.01 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' B' ' 2' ' ' PRO . 36.0 Cg_exo -58.7 161.07 15.79 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 123.594 2.863 . . . . 0.0 118.297 179.051 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -71.45 117.92 5.4 Favored 'Trans proline' 0 C--N 1.37 1.69 0 N-CA-C 105.498 -2.539 . . . . 0.0 105.498 174.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.435 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.1 t -65.56 147.34 98.73 Favored Pre-proline 0 CA--C 1.551 0.997 0 CA-C-N 113.685 -1.598 . . . . 0.0 109.135 -178.194 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 6' ' ' PRO . . . . . 0.435 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 2.8 Cg_exo -68.1 159.64 52.19 Favored 'Trans proline' 0 C--N 1.363 1.329 0 N-CA-C 116.805 1.81 . . . . 0.0 116.805 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 7' ' ' PRO . . . . . 0.504 ' HG2' HH21 ' B' ' 10' ' ' ARG . 10.0 Cg_endo -76.28 119.81 5.42 Favored 'Trans proline' 0 CA--C 1.553 1.443 0 N-CA-C 107.785 -1.659 . . . . 0.0 107.785 175.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.34 168.45 10.56 Favored 'General case' 0 C--N 1.362 1.118 0 C-N-CA 118.495 -1.282 . . . . 0.0 109.879 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 74.68 73.53 0.1 Allowed 'General case' 0 C--N 1.356 0.865 0 CA-C-N 113.139 -1.846 . . . . 0.0 107.95 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 10' ' ' ARG . . . . . 0.504 HH21 ' HG2' ' B' ' 7' ' ' PRO 0.339 0.0 OUTLIER -164.41 96.58 0.77 Allowed 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 112.529 -2.123 . . . . 0.0 110.419 178.097 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.129 0 CA-C-N 114.764 -1.107 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.452 -0.337 0 CA-C-O 121.997 0.903 . . . . 0.0 109.27 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.5 157.18 18.22 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.515 -178.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.803 ' HB1' HD11 ' A' ' 53' ' ' ILE . . . -141.09 153.85 45.64 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 110.615 -2.993 . . . . 0.0 105.139 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.7 mt -146.67 112.75 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 N-CA-C 104.924 -2.251 . . . . 0.0 104.924 -174.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.21 144.2 55.02 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-N 112.033 -2.349 . . . . 0.0 110.715 -178.226 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 mtmt -98.95 -28.04 13.61 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 128.21 2.604 . . . . 0.0 113.205 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.507 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 58.8 m-85 -144.63 164.21 31.63 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 117.521 -1.672 . . . . 0.0 108.463 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -64.53 143.57 57.82 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 113.398 -1.728 . . . . 0.0 107.876 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -142.46 142.67 32.35 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 122.857 1.313 . . . . 0.0 107.902 177.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.25 115.55 16.47 Favored 'General case' 0 CA--C 1.56 1.332 0 CA-C-N 111.632 -2.531 . . . . 0.0 109.687 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.35 147.93 2.13 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.372 0.606 . . . . 0.0 112.435 -177.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.7 p -121.96 -5.52 9.03 Favored 'General case' 0 C--N 1.353 0.74 0 CA-C-N 113.449 -1.705 . . . . 0.0 112.602 -178.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.55 165.34 34.55 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-O 123.34 1.543 . . . . 0.0 110.287 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -50.67 -35.99 33.57 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 110.28 -3.145 . . . . 0.0 115.453 -178.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 52.4 p-10 -93.23 0.9 57.22 Favored 'General case' 0 C--N 1.352 0.684 0 O-C-N 124.444 1.09 . . . . 0.0 113.811 -176.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -109.81 160.81 16.03 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 114.152 -1.385 . . . . 0.0 109.71 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.765 HD11 ' HB2' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -135.8 161.09 36.56 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-N 113.754 -1.566 . . . . 0.0 110.109 179.813 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.531 ' O ' HD12 ' A' ' 17' ' ' LEU . 3.0 m -84.87 163.74 18.83 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 113.676 -1.602 . . . . 0.0 115.186 -179.158 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 50.9 p90 -164.41 160.46 20.7 Favored 'General case' 0 C--N 1.359 0.991 0 CA-C-N 110.85 -2.886 . . . . 0.0 109.788 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.36 119.36 16.42 Favored 'General case' 0 C--N 1.348 0.542 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.671 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -4.04 92.58 0.01 OUTLIER 'General case' 0 C--N 1.363 1.154 0 C-N-CA 127.185 2.194 . . . . 0.0 114.23 -178.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 118.29 8.03 10.68 Favored Glycine 0 C--N 1.353 1.485 0 O-C-N 125.014 1.446 . . . . 0.0 116.252 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.566 ' HB3' HD21 ' A' ' 41' ' ' LEU . 59.5 m-20 -62.28 152.95 32.15 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 117.372 -1.731 . . . . 0.0 112.936 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 83.6 mt -96.16 112.22 27.94 Favored 'Isoleucine or valine' 0 C--N 1.352 0.702 0 N-CA-C 104.895 -2.261 . . . . 0.0 104.895 178.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.809 HD11 HD11 ' A' ' 41' ' ' LEU . 0.3 OUTLIER -103.93 145.79 29.62 Favored 'General case' 0 C--N 1.352 0.706 0 CA-C-N 113.302 -1.772 . . . . 0.0 111.037 -176.027 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.12 113.03 24.15 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-N 111.714 -2.494 . . . . 0.0 108.429 177.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 t -86.35 108.03 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 115.106 -2.638 . . . . 0.0 111.404 -174.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.434 ' HA ' HD12 ' A' ' 28' ' ' LEU . 12.4 tp -91.79 -4.2 55.22 Favored 'General case' 0 C--N 1.351 0.641 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 -178.358 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -174.63 137.25 0.46 Allowed 'General case' 0 C--N 1.348 0.536 0 C-N-CA 117.827 -1.549 . . . . 0.0 107.667 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -154.18 86.8 1.17 Allowed 'General case' 0 C--N 1.348 0.515 0 CA-C-N 113.714 -1.585 . . . . 0.0 108.541 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.439 ' CG ' ' H ' ' A' ' 32' ' ' CYS . 2.1 tp10 -74.23 -151.88 0.03 OUTLIER 'General case' 0 N--CA 1.421 -1.892 0 CA-C-N 112.903 -1.953 . . . . 0.0 106.663 178.13 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.439 ' H ' ' CG ' ' A' ' 31' ' ' GLU . 87.1 m -81.66 -9.42 59.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 112.656 -2.065 . . . . 0.0 112.144 -177.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.27 106.87 1.18 Allowed 'General case' 0 C--N 1.374 1.664 0 C-N-CA 117.339 -1.744 . . . . 0.0 109.694 -178.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -92.11 106.78 18.72 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 178.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 141.62 -13.64 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 O-C-N 126.853 2.596 . . . . 0.0 111.624 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.7 m95 -139.0 154.84 48.3 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-O 121.316 0.579 . . . . 0.0 110.373 -177.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -136.15 137.57 41.09 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 104.728 -2.323 . . . . 0.0 104.728 175.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -98.78 117.48 33.35 Favored 'General case' 0 C--N 1.353 0.723 0 N-CA-C 105.212 -2.144 . . . . 0.0 105.212 176.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.38 174.95 10.0 Favored 'General case' 0 C--N 1.352 0.68 0 O-C-N 124.346 1.029 . . . . 0.0 111.793 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.5 132.15 52.85 Favored 'General case' 0 C--N 1.359 1.018 0 O-C-N 124.482 1.114 . . . . 0.0 110.23 -178.292 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.809 HD11 HD11 ' A' ' 25' ' ' LEU 0.257 9.8 mt -159.84 145.8 15.77 Favored 'General case' 0 C--N 1.36 1.025 0 CA-C-N 111.482 -2.599 . . . . 0.0 114.736 178.739 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.26 28.27 13.03 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 110.723 -2.944 . . . . 0.0 115.011 170.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.9 11.54 82.53 Favored Glycine 0 CA--C 1.541 1.688 0 C-N-CA 119.612 -1.28 . . . . 0.0 114.509 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -138.51 -177.89 5.05 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-O 122.566 1.174 . . . . 0.0 110.225 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -141.93 133.07 26.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 112.232 -2.258 . . . . 0.0 105.556 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.427 ' CA ' HD23 ' A' ' 17' ' ' LEU . . . -173.05 173.65 45.68 Favored Glycine 0 C--N 1.338 0.688 0 C-N-CA 117.437 -2.316 . . . . 0.0 111.834 -178.202 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -77.73 146.61 35.83 Favored 'General case' 0 CA--C 1.56 1.356 0 CA-C-N 112.54 -1.83 . . . . 0.0 110.665 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.9 pt -143.79 144.75 28.16 Favored Pre-proline 0 C--N 1.352 0.711 0 CA-C-N 111.414 -2.63 . . . . 0.0 107.475 177.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -80.18 138.61 12.81 Favored 'Trans proline' 0 C--N 1.367 1.534 0 N-CA-C 114.808 1.042 . . . . 0.0 114.808 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.52 -35.06 70.58 Favored 'General case' 0 C--N 1.354 0.768 0 CA-C-O 117.009 -1.472 . . . . 0.0 113.009 -178.44 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.277 0.5 OUTLIER -63.03 -10.71 15.06 Favored 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 113.046 -3.462 . . . . 0.0 112.834 178.146 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -94.67 -15.08 24.25 Favored 'General case' 0 CA--C 1.555 1.159 0 CA-C-O 117.47 -1.253 . . . . 0.0 108.942 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.803 HD11 ' HB1' ' A' ' 3' ' ' ALA . 0.0 OUTLIER -133.98 160.56 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-O 122.901 1.334 . . . . 0.0 111.111 178.481 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.449 ' H ' HG12 ' A' ' 53' ' ' ILE . 18.3 tt0 -126.9 145.01 50.83 Favored 'General case' 0 C--N 1.346 0.424 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 178.048 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.13 162.31 18.45 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.261 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.77 92.49 3.62 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-N 112.825 -1.989 . . . . 0.0 108.203 -179.414 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo . . . . . 0 C--N 1.363 1.293 0 C-N-CA 121.166 1.244 . . . . 0.0 111.768 179.054 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.225 -0.229 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 61.9 t -99.33 111.55 61.43 Favored Pre-proline 0 C--N 1.348 0.54 0 O-C-N 125.457 1.723 . . . . 0.0 107.621 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 2' ' ' PRO . . . . . 0.507 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 3.2 Cg_exo -71.24 164.17 36.66 Favored 'Trans proline' 0 CA--C 1.571 2.331 0 N-CA-C 116.494 1.69 . . . . 0.0 116.494 176.588 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -50.6 160.18 1.83 Allowed 'Trans proline' 0 C--N 1.372 1.816 0 C-N-CA 124.499 3.466 . . . . 0.0 118.74 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -75.69 112.77 3.59 Favored 'Trans proline' 0 C--N 1.357 1.02 0 N-CA-C 106.621 -2.107 . . . . 0.0 106.621 176.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 3.5 t -58.26 143.61 79.08 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 113.256 -1.793 . . . . 0.0 109.824 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -61.2 150.31 85.16 Favored 'Trans proline' 0 C--N 1.359 1.117 0 O-C-N 122.789 0.889 . . . . 0.0 114.067 179.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_endo -67.68 111.78 2.46 Favored 'Trans proline' 0 C--N 1.364 1.391 0 N-CA-C 107.713 -1.687 . . . . 0.0 107.713 177.064 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.63 96.92 7.01 Favored 'General case' 0 C--N 1.353 0.761 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 -178.682 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 6.0 mtp85 -160.88 62.13 0.3 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 112.178 -2.283 . . . . 0.0 111.466 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 174.28 132.74 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 113.43 -1.713 . . . . 0.0 106.384 178.546 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 0.413 0 CA-C-N 114.489 -1.232 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.475 ' HG2' HG11 ' A' ' 27' ' ' VAL . 1.0 OUTLIER . . . . . 0 N--CA 1.465 0.279 0 CA-C-O 121.81 0.814 . . . . 0.0 109.488 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -105.86 143.85 33.41 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 112.719 -2.037 . . . . 0.0 105.633 -177.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.692 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . -133.77 156.53 47.82 Favored 'General case' 0 C--N 1.351 0.656 0 CA-C-N 112.33 -2.214 . . . . 0.0 109.132 -177.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.1 mt -145.01 117.42 2.34 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 CA-C-N 112.647 -2.07 . . . . 0.0 109.762 -176.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.43 125.22 26.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 117.296 -1.762 . . . . 0.0 108.311 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.9 -24.95 16.18 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.521 -1.218 . . . . 0.0 114.139 -178.349 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.588 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 41.6 m-85 -142.49 165.65 26.83 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -68.84 157.97 35.42 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 116.69 -2.004 . . . . 0.0 109.173 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.488 ' HE1' HG21 ' B' ' 5' ' ' VAL . 12.6 t80 -145.96 142.78 29.02 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 118.554 -1.258 . . . . 0.0 108.895 175.366 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -129.44 100.96 5.75 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 127.333 2.253 . . . . 0.0 108.993 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.93 160.26 0.04 OUTLIER 'General case' 0 C--N 1.352 0.696 0 CA-C-O 123.079 1.419 . . . . 0.0 113.862 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 p -117.12 -25.63 7.08 Favored 'General case' 0 CA--C 1.557 1.247 0 CA-C-N 110.648 -2.978 . . . . 0.0 112.348 -178.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.73 168.15 26.63 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 117.096 -1.842 . . . . 0.0 110.628 -177.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -42.54 -40.58 2.7 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 109.949 -3.296 . . . . 0.0 114.352 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -85.83 0.86 51.87 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -177.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -112.13 155.84 23.26 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 178.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.553 HD12 ' C ' ' A' ' 17' ' ' LEU . 1.4 pp -136.63 155.58 49.71 Favored 'General case' 0 C--N 1.345 0.411 0 CA-C-N 113.371 -1.74 . . . . 0.0 108.422 178.463 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.0 m -87.15 173.17 9.41 Favored 'General case' 0 CA--C 1.47 -2.125 0 N-CA-C 119.274 3.065 . . . . 0.0 119.274 -177.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -162.88 -175.6 4.48 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 108.532 -3.94 . . . . 0.0 108.625 175.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.73 140.58 34.88 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 112.328 -2.214 . . . . 0.0 105.95 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.81 101.57 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.875 0 O-C-N 124.974 1.421 . . . . 0.0 111.63 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 136.3 -25.04 3.19 Favored Glycine 0 C--N 1.355 1.59 0 CA-C-N 113.96 -1.473 . . . . 0.0 114.232 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -58.38 145.86 36.81 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 117.036 -1.865 . . . . 0.0 112.8 -177.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.2 mm -97.58 113.95 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 103.398 -2.815 . . . . 0.0 103.398 178.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.612 ' CD1' HD11 ' A' ' 41' ' ' LEU . 1.4 mm? -100.96 162.78 12.65 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 116.241 -2.184 . . . . 0.0 109.697 -175.463 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -103.31 111.07 23.31 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 108.949 -3.751 . . . . 0.0 105.903 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.674 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 90.1 t -87.83 100.34 10.07 Favored 'Isoleucine or valine' 0 C--N 1.342 0.275 0 C-N-CA 116.391 -2.124 . . . . 0.0 111.259 -175.018 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -95.5 90.1 5.64 Favored 'General case' 0 C--N 1.349 0.579 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 177.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 57.66 -177.46 0.06 Allowed 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 113.306 -1.77 . . . . 0.0 112.737 178.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -158.26 115.07 2.84 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 110.643 -2.981 . . . . 0.0 106.365 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.42 ' O ' ' CB ' ' A' ' 32' ' ' CYS . 6.0 pt-20 -171.5 116.92 0.42 Allowed 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 118.203 -1.399 . . . . 0.0 108.302 -178.126 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 31' ' ' GLU . 2.0 t 149.76 -51.85 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 113.486 -1.688 . . . . 0.0 110.786 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -159.11 116.97 2.81 Favored 'General case' 0 C--N 1.359 0.987 0 C-N-CA 117.47 -1.692 . . . . 0.0 111.932 179.284 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -61.74 107.63 0.86 Allowed 'General case' 0 C--N 1.351 0.638 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 179.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.6 m-20 145.1 -11.2 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.074 0 O-C-N 128.046 3.341 . . . . 0.0 113.004 -174.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -136.39 161.01 37.02 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.997 0.903 . . . . 0.0 109.517 -177.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -131.91 145.1 51.31 Favored 'General case' 0 C--N 1.345 0.381 0 CA-C-N 112.926 -1.943 . . . . 0.0 106.4 178.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 38.8 tttm -101.65 121.27 41.71 Favored 'General case' 0 C--N 1.348 0.523 0 N-CA-C 105.852 -1.906 . . . . 0.0 105.852 177.285 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -142.29 176.4 9.02 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 118.719 -1.192 . . . . 0.0 113.464 -176.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -120.73 140.18 52.02 Favored 'General case' 0 C--O 1.203 -1.362 0 CA-C-O 123.608 1.67 . . . . 0.0 111.879 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.612 HD11 ' CD1' ' A' ' 25' ' ' LEU 0.29 16.1 mt -162.14 154.66 19.65 Favored 'General case' 0 C--O 1.189 -2.109 0 CA-C-N 110.033 -3.258 . . . . 0.0 114.005 178.055 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 48.69 23.4 0.64 Allowed 'General case' 0 CA--C 1.555 1.163 0 O-C-N 127.163 2.79 . . . . 0.0 116.237 169.58 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.94 -5.43 85.13 Favored Glycine 0 CA--C 1.559 2.825 0 N-CA-C 116.439 1.336 . . . . 0.0 116.439 -178.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.9 mtmt -118.57 173.43 6.85 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 123.163 1.459 . . . . 0.0 107.811 177.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.548 ' C ' HD23 ' A' ' 17' ' ' LEU . 35.0 p-10 -142.6 133.31 25.37 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 111.7 -2.5 . . . . 0.0 106.8 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.42 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -169.36 178.03 42.69 Favored Glycine 0 C--N 1.346 1.124 0 C-N-CA 117.091 -2.48 . . . . 0.0 111.344 -178.434 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -77.46 146.96 36.16 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 118.62 -1.232 . . . . 0.0 112.684 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 21.1 pt -142.29 137.74 15.93 Favored Pre-proline 0 C--N 1.359 0.999 0 CA-C-N 112.62 -2.082 . . . . 0.0 107.506 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -70.38 147.89 59.88 Favored 'Trans proline' 0 C--N 1.356 0.955 0 N-CA-C 114.339 0.861 . . . . 0.0 114.339 -176.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -71.11 -43.29 67.94 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 116.597 -2.041 . . . . 0.0 111.371 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.418 HD22 ' HB2' ' B' ' 3' ' ' PRO . 8.0 p-10 -53.91 -23.99 14.63 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 178.743 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' TYR . . . . . 0.618 ' CE1' HG22 ' B' ' 5' ' ' VAL . 6.4 m-85 -89.54 -3.23 58.42 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 118.986 -1.086 . . . . 0.0 111.518 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.692 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -129.54 173.61 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.142 0 CA-C-N 119.64 1.109 . . . . 0.0 108.909 178.775 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.413 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 31.3 tt0 -129.81 121.03 25.98 Favored 'General case' 0 C--N 1.347 0.49 0 N-CA-C 103.487 -2.783 . . . . 0.0 103.487 178.148 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -87.36 160.63 18.3 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-N 113.143 -1.844 . . . . 0.0 112.143 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -154.61 80.92 4.49 Favored Pre-proline 0 CA--C 1.55 0.946 0 CA-C-N 112.595 -2.093 . . . . 0.0 109.533 177.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo . . . . . 0 C--N 1.367 1.54 0 C-N-CA 121.074 1.183 . . . . 0.0 110.584 179.231 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.376 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 5.3 p -97.56 119.66 62.24 Favored Pre-proline 0 CA--C 1.539 0.531 0 O-C-N 124.917 1.386 . . . . 0.0 108.322 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 2' ' ' PRO . . . . . 0.588 ' HB3' ' CD2' ' A' ' 7' ' ' TYR 0.258 3.4 Cg_exo -70.22 151.71 66.55 Favored 'Trans proline' 0 N--CA 1.431 -2.195 0 N-CA-C 115.186 1.187 . . . . 0.0 115.186 176.851 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.418 ' HB2' HD22 ' A' ' 51' ' ' ASN . 51.5 Cg_exo -45.91 155.52 0.56 Allowed 'Trans proline' 0 C--N 1.368 1.586 0 C-N-CA 123.127 2.551 . . . . 0.0 116.518 -179.436 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -76.0 105.82 2.15 Favored 'Trans proline' 0 C--N 1.366 1.484 0 N-CA-C 106.256 -2.248 . . . . 0.0 106.256 178.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.618 HG22 ' CE1' ' A' ' 52' ' ' TYR . 4.2 t -50.36 146.13 9.37 Favored Pre-proline 0 CA--C 1.559 1.314 0 CA-C-N 113.492 -1.686 . . . . 0.0 110.639 -178.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.69 155.66 69.4 Favored 'Trans proline' 0 C--N 1.365 1.44 0 C-N-CA 120.937 1.091 . . . . 0.0 113.854 178.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -73.37 110.29 3.03 Favored 'Trans proline' 0 C--N 1.356 0.928 0 N-CA-C 106.164 -2.283 . . . . 0.0 106.164 176.492 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.17 94.67 4.12 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 116.747 -1.981 . . . . 0.0 106.247 -179.448 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 4.9 ttm180 -141.63 -77.48 0.28 Allowed 'General case' 0 N--CA 1.425 -1.716 0 CA-C-N 111.062 -2.79 . . . . 0.0 109.187 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -174.46 90.81 0.07 Allowed 'General case' 0 N--CA 1.434 -1.233 1 CA-C-N 108.307 -4.042 . . . . 0.0 109.385 -179.871 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.268 0 CA-C-N 114.071 -1.422 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.397 0 CA-C-O 121.445 0.641 . . . . 0.0 110.904 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -100.66 152.81 20.0 Favored 'General case' 0 C--N 1.363 1.175 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 176.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.759 ' HB2' HG13 ' A' ' 27' ' ' VAL . . . -136.65 152.69 50.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 111.903 -2.408 . . . . 0.0 108.497 -178.043 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.2 mt -150.19 122.6 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.352 0.706 0 CA-C-N 113.239 -1.8 . . . . 0.0 109.784 -175.809 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.517 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -67.04 127.57 33.07 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 113.31 -1.768 . . . . 0.0 110.788 178.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.12 -24.14 18.37 Favored 'General case' 0 CA--C 1.558 1.274 0 CA-C-N 113.887 -1.506 . . . . 0.0 112.577 178.649 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -141.34 166.5 24.6 Favored 'General case' 0 C--N 1.355 0.836 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.019 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -68.86 156.21 38.84 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 116.689 -2.004 . . . . 0.0 108.176 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -146.24 138.82 25.39 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 174.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.407 ' O ' ' CD ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -129.39 103.24 6.8 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 106.506 -1.664 . . . . 0.0 106.506 177.266 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.96 157.62 0.15 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 122.954 1.359 . . . . 0.0 112.236 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -148.29 20.82 1.08 Allowed 'General case' 0 CA--C 1.565 1.548 0 CA-C-N 111.073 -2.785 . . . . 0.0 114.19 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.84 140.7 20.11 Favored 'General case' 0 C--N 1.348 0.527 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -43.08 -32.85 0.75 Allowed 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 114.131 -1.395 . . . . 0.0 114.048 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 53.8 p30 -92.54 -4.59 53.26 Favored 'General case' 0 CA--C 1.568 1.663 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 -178.506 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -107.34 154.74 20.84 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.89 0.852 . . . . 0.0 108.849 -178.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 pp -133.3 158.72 42.24 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 112.481 -2.145 . . . . 0.0 111.161 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.7 m -85.75 171.63 11.45 Favored 'General case' 0 C--N 1.35 0.601 0 N-CA-C 117.191 2.293 . . . . 0.0 117.191 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.4 p90 -164.36 166.53 20.67 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 109.827 -3.352 . . . . 0.0 109.115 174.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -134.96 111.72 10.05 Favored 'General case' 0 CA--C 1.557 1.236 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.367 178.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -3.88 93.23 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 127.516 2.326 . . . . 0.0 113.962 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.517 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 120.38 3.7 11.4 Favored Glycine 0 CA--C 1.547 2.034 0 CA-C-N 113.688 -1.596 . . . . 0.0 116.495 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.523 ' HB3' HD21 ' A' ' 41' ' ' LEU . 59.8 m-20 -59.12 155.45 13.89 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-O 122.58 1.181 . . . . 0.0 113.196 -178.074 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 pt -96.93 103.92 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.319 0 CA-C-N 111.16 -2.745 . . . . 0.0 104.851 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.606 HD21 HD11 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -108.05 158.95 16.95 Favored 'General case' 0 C--N 1.349 0.587 0 CA-C-N 113.804 -1.543 . . . . 0.0 110.812 -176.181 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.73 109.64 14.49 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 112.295 -2.23 . . . . 0.0 107.192 177.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.759 HG13 ' HB2' ' A' ' 3' ' ' ALA . 1.8 m -85.88 114.98 26.49 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 C-N-CA 117.099 -1.84 . . . . 0.0 110.24 -176.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.585 HD13 ' O ' ' A' ' 28' ' ' LEU . 1.3 tm? -88.81 -8.47 54.3 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 111.828 -2.442 . . . . 0.0 117.015 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -177.0 164.32 2.27 Favored 'General case' 0 C--N 1.351 0.662 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.141 -178.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -168.62 77.14 0.12 Allowed 'General case' 0 C--N 1.348 0.527 0 C-N-CA 115.456 -2.498 . . . . 0.0 111.744 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 174.93 48.31 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 111.872 -2.422 . . . . 0.0 110.241 -179.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 44.6 m -100.5 -54.45 2.84 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-N 114.52 -1.218 . . . . 0.0 112.379 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -165.35 74.39 0.22 Allowed 'General case' 0 C--N 1.348 0.538 0 O-C-N 125.748 1.905 . . . . 0.0 107.793 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -17.61 90.82 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 128.384 2.673 . . . . 0.0 112.581 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.2 m120 146.62 -1.61 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 131.583 3.953 . . . . 0.0 114.87 -171.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -139.96 168.47 19.73 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 121.535 0.684 . . . . 0.0 109.406 -176.909 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -140.87 150.1 42.8 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.396 -1.274 . . . . 0.0 107.841 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -103.99 117.95 35.51 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 105.397 -2.075 . . . . 0.0 105.397 176.171 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -140.5 176.62 8.63 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 123.982 0.801 . . . . 0.0 112.399 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -112.03 135.75 52.28 Favored 'General case' 0 C--N 1.364 1.21 0 O-C-N 123.89 0.743 . . . . 0.0 109.728 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.606 HD11 HD21 ' A' ' 25' ' ' LEU . 18.5 mt -160.36 143.67 13.64 Favored 'General case' 0 CA--C 1.468 -2.181 0 C-N-CA 126.864 2.066 . . . . 0.0 115.685 -178.934 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.25 32.31 18.33 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 115.358 -2.537 . . . . 0.0 115.967 168.437 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.1 -4.92 68.61 Favored Glycine 0 CA--C 1.558 2.774 0 C-N-CA 119.891 -1.147 . . . . 0.0 115.696 -178.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.0 -175.68 3.29 Favored 'General case' 0 C--N 1.352 0.705 0 CA-C-O 122.983 1.373 . . . . 0.0 109.505 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -142.48 134.25 26.9 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 111.61 -2.541 . . . . 0.0 104.789 178.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.45 175.5 45.59 Favored Glycine 0 C--N 1.35 1.317 0 C-N-CA 116.373 -2.822 . . . . 0.0 112.215 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -77.49 143.67 38.31 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 117.927 -1.509 . . . . 0.0 112.014 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.711 HD12 HG21 ' A' ' 53' ' ' ILE . 3.8 pt -142.57 144.59 30.98 Favored Pre-proline 0 C--N 1.356 0.865 0 CA-C-N 112.064 -2.335 . . . . 0.0 107.817 179.121 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -77.79 155.38 30.79 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 N-CA-C 118.471 2.451 . . . . 0.0 118.471 -177.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.7 mttt -68.61 -56.5 8.03 Favored 'General case' 0 C--N 1.36 1.042 0 CA-C-N 112.651 -2.068 . . . . 0.0 110.261 178.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.321 0.7 OUTLIER -59.19 -8.34 1.55 Allowed 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 115.28 -2.568 . . . . 0.0 115.683 -179.752 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -95.07 -11.54 28.13 Favored 'General case' 0 CA--C 1.567 1.622 0 CA-C-O 117.642 -1.17 . . . . 0.0 113.55 175.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.711 HG21 HD12 ' A' ' 48' ' ' ILE . 0.1 OUTLIER -133.15 166.56 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 CA-C-N 120.368 1.44 . . . . 0.0 110.159 -178.915 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.404 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 8.3 tt0 -127.71 136.02 50.97 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 112.543 -2.117 . . . . 0.0 105.583 175.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.434 ' CE ' HG11 ' A' ' 27' ' ' VAL . 5.5 mtp -85.24 167.83 15.3 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 114.04 -1.436 . . . . 0.0 108.885 179.0 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.1 mtpt -155.0 93.18 2.77 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 117.464 -1.694 . . . . 0.0 111.519 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo . . . . . 0 C--N 1.364 1.379 0 C-N-CA 121.687 1.592 . . . . 0.0 108.556 173.746 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.357 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 53.3 t -56.52 106.84 0.73 Allowed Pre-proline 0 CA--C 1.548 0.885 0 O-C-N 124.747 1.279 . . . . 0.0 109.033 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -70.41 156.38 61.76 Favored 'Trans proline' 0 N--CA 1.443 -1.47 0 N-CA-C 117.063 1.909 . . . . 0.0 117.063 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -50.58 159.13 2.33 Favored 'Trans proline' 0 C--N 1.369 1.614 0 C-N-CA 122.07 1.847 . . . . 0.0 115.141 177.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -71.07 119.47 6.33 Favored 'Trans proline' 0 C--N 1.363 1.328 0 N-CA-C 104.394 -2.964 . . . . 0.0 104.394 176.08 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.418 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 5.4 t -62.85 148.85 91.12 Favored Pre-proline 0 CA--C 1.545 0.771 0 O-C-N 124.59 1.181 . . . . 0.0 108.39 -178.317 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 6' ' ' PRO . . . . . 0.418 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 12.3 Cg_exo -67.43 163.62 33.98 Favored 'Trans proline' 0 N--CA 1.443 -1.465 0 N-CA-C 115.778 1.415 . . . . 0.0 115.778 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -71.62 119.42 6.22 Favored 'Trans proline' 0 C--N 1.364 1.372 0 O-C-N 124.633 1.86 . . . . 0.0 108.589 175.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.42 67.85 2.94 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-O 123.349 1.547 . . . . 0.0 109.167 178.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 165.1 84.56 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 110.447 -3.069 . . . . 0.0 106.104 -179.846 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -9.6 -63.68 0.0 OUTLIER 'General case' 0 C--N 1.352 0.678 0 CA-C-N 111.139 -2.755 . . . . 0.0 113.585 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.085 0 CA-C-N 110.304 -3.134 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.586 ' CG ' ' H ' ' A' ' 2' ' ' GLU . 2.9 ttp . . . . . 0 N--CA 1.437 -1.118 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.586 ' H ' ' CG ' ' A' ' 1' ' ' MET . 15.3 pt-20 -6.64 -172.69 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.513 1 C-N-CA 133.929 4.892 . . . . 0.0 119.408 173.89 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.613 ' HA ' HD12 ' A' ' 53' ' ' ILE . . . 87.93 133.96 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.104 2 C-N-CA 138.153 6.581 . . . . 0.0 109.764 178.696 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.629 HD13 ' HA ' ' A' ' 24' ' ' ILE . 11.4 mm -148.11 123.19 2.25 Favored 'Isoleucine or valine' 0 C--N 1.354 0.793 0 CA-C-N 109.04 -3.709 . . . . 0.0 106.391 -178.433 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.71 125.87 27.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.919 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -96.55 -22.89 16.8 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 113.119 -1.855 . . . . 0.0 114.215 -179.023 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -142.22 168.87 18.72 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 124.807 1.317 . . . . 0.0 107.75 -179.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -68.0 146.63 53.37 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 118.17 -1.412 . . . . 0.0 107.832 177.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -145.69 128.78 16.59 Favored 'General case' 0 C--N 1.355 0.841 0 C-N-CA 117.385 -1.726 . . . . 0.0 108.967 176.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.21 102.09 9.28 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-N 111.007 -2.815 . . . . 0.0 109.045 -178.106 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.05 170.02 0.01 OUTLIER 'General case' 0 C--N 1.382 1.996 0 CA-C-O 124.418 2.056 . . . . 0.0 113.28 -179.128 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.306 44.2 p -123.92 -25.15 4.29 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 109.886 -3.324 . . . . 0.0 111.175 -177.315 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.05 172.75 16.39 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 117.81 -1.556 . . . . 0.0 112.259 -174.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -59.84 -25.47 65.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 110.99 -2.823 . . . . 0.0 113.931 -177.034 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -87.32 -7.66 57.55 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 118.952 -1.099 . . . . 0.0 111.082 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -111.24 162.82 14.58 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 114.043 -1.435 . . . . 0.0 107.495 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.626 HD23 ' N ' ' A' ' 46' ' ' GLY . 0.4 OUTLIER -138.08 156.84 47.37 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 113.827 -1.533 . . . . 0.0 109.029 178.316 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' SER . . . . . 0.569 ' O ' HD12 ' A' ' 17' ' ' LEU . 3.1 m -86.59 162.9 17.75 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 123.425 1.583 . . . . 0.0 115.191 -178.259 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -162.74 167.77 22.51 Favored 'General case' 0 C--N 1.356 0.854 0 CA-C-N 109.307 -3.588 . . . . 0.0 107.871 175.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.52 147.11 52.17 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 111.005 -2.816 . . . . 0.0 104.71 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -43.04 99.49 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.707 0 O-C-N 125.835 1.96 . . . . 0.0 113.089 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.89 -34.41 1.86 Allowed Glycine 0 C--N 1.351 1.389 0 CA-C-N 113.623 -1.626 . . . . 0.0 115.527 177.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -45.85 151.82 0.42 Allowed 'General case' 0 C--N 1.359 1.016 0 N-CA-C 115.687 1.736 . . . . 0.0 115.687 -177.169 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.629 ' HA ' HD13 ' A' ' 4' ' ' ILE . 6.9 mt -100.62 121.66 51.67 Favored 'Isoleucine or valine' 0 C--N 1.35 0.622 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 176.2 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.709 HD11 HD11 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -106.86 140.96 38.86 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 -179.003 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.02 110.91 23.0 Favored 'General case' 0 C--O 1.209 -1.069 2 CA-C-N 107.181 -4.554 . . . . 0.0 107.622 -179.173 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 1' ' ' MET . 3.5 m -88.05 115.58 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 C-N-CA 118.703 -1.199 . . . . 0.0 110.7 -176.256 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.74 -9.92 27.91 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-N 113.017 -1.901 . . . . 0.0 110.831 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 179.5 150.92 0.35 Allowed 'General case' 0 C--N 1.356 0.857 0 CA-C-N 115.426 -0.806 . . . . 0.0 108.982 -178.188 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.41 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 1.9 pm0 -171.03 100.08 0.21 Allowed 'General case' 0 C--N 1.365 1.265 0 C-N-CA 117.173 -1.811 . . . . 0.0 111.746 -178.409 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.41 ' HB3' ' O ' ' A' ' 30' ' ' GLU . 12.6 pt-20 170.76 31.16 0.0 OUTLIER 'General case' 0 C--N 1.354 0.769 0 O-C-N 125.914 2.008 . . . . 0.0 112.64 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 15.3 p -74.09 -56.15 5.26 Favored 'General case' 0 C--N 1.349 0.573 0 CA-C-N 114.12 -1.4 . . . . 0.0 108.892 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -160.85 48.83 0.23 Allowed 'General case' 0 CA--C 1.558 1.266 0 O-C-N 124.922 1.389 . . . . 0.0 113.53 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 16.34 80.19 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 128.637 2.775 . . . . 0.0 113.578 177.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 172.46 -12.65 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.354 0 C-N-CA 130.112 3.365 . . . . 0.0 110.763 -177.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 69.4 m95 -129.65 174.3 9.82 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-O 121.8 0.809 . . . . 0.0 110.25 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -142.83 138.14 30.12 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 126.058 1.743 . . . . 0.0 107.145 174.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.6 tttm -100.2 114.87 28.61 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 175.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -136.08 172.69 12.65 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 118.671 -1.212 . . . . 0.0 111.578 -175.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -112.6 145.46 40.33 Favored 'General case' 0 C--N 1.367 1.355 0 O-C-N 125.481 1.738 . . . . 0.0 110.53 -177.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.709 HD11 HD11 ' A' ' 25' ' ' LEU 0.295 4.4 mt -159.22 135.6 9.14 Favored 'General case' 0 C--N 1.361 1.104 0 CA-C-N 109.086 -3.688 . . . . 0.0 112.794 178.815 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.87 28.43 10.43 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 112.431 -2.168 . . . . 0.0 114.971 170.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 72.37 29.14 66.59 Favored Glycine 0 CA--C 1.55 2.244 0 C-N-CA 119.775 -1.202 . . . . 0.0 114.067 -179.186 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -139.31 157.82 45.23 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 126.782 2.033 . . . . 0.0 107.711 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -139.73 142.28 36.83 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.626 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -176.95 173.62 46.44 Favored Glycine 0 CA--C 1.53 1.024 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.874 -179.179 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -77.18 145.36 37.71 Favored 'General case' 0 CA--C 1.573 1.827 0 CA-C-O 122.834 1.302 . . . . 0.0 111.542 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.598 ' CD1' HD23 ' A' ' 25' ' ' LEU . 47.2 pt -143.73 143.89 25.11 Favored Pre-proline 0 C--N 1.355 0.827 0 CA-C-N 113.6 -1.636 . . . . 0.0 107.685 178.025 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.4 ' HG3' HG13 ' B' ' 5' ' ' VAL . 11.3 Cg_endo -73.06 144.91 38.66 Favored 'Trans proline' 0 C--N 1.346 0.447 0 N-CA-C 114.318 0.853 . . . . 0.0 114.318 -177.275 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.04 -40.79 71.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 115.071 -2.652 . . . . 0.0 111.985 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.453 HD22 ' HB2' ' B' ' 3' ' ' PRO . 10.5 p-10 -55.43 -19.39 9.15 Favored 'General case' 0 CA--C 1.562 1.411 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 177.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -93.25 -4.39 51.96 Favored 'General case' 0 C--N 1.366 1.309 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.613 HD12 ' HA ' ' A' ' 3' ' ' ALA . 0.4 OUTLIER -129.25 176.92 7.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.665 0 CA-C-O 122.991 1.377 . . . . 0.0 111.216 -179.412 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -132.32 138.53 47.83 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 110.807 -2.906 . . . . 0.0 104.942 177.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.42 ' O ' ' HD3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -89.34 141.8 28.22 Favored 'General case' 0 C--N 1.35 0.611 0 O-C-N 124.25 0.969 . . . . 0.0 111.691 176.834 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -97.07 92.42 1.17 Allowed Pre-proline 0 CA--C 1.583 2.222 0 O-C-N 124.196 0.935 . . . . 0.0 110.96 171.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.42 ' HD3' ' O ' ' A' ' 55' ' ' MET . 12.4 Cg_endo . . . . . 0 C--N 1.381 2.281 0 C-N-CA 122.946 2.43 . . . . 0.0 111.381 176.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.225 -0.233 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 7.4 p 23.09 117.91 0.0 OUTLIER Pre-proline 0 C--N 1.352 0.714 0 C-N-CA 128.276 2.63 . . . . 0.0 112.415 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -73.03 153.48 52.29 Favored 'Trans proline' 0 N--CA 1.44 -1.645 0 C-N-CA 117.541 -1.173 . . . . 0.0 114.378 176.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.453 ' HB2' HD22 ' A' ' 51' ' ' ASN . 74.2 Cg_exo -51.79 162.09 1.89 Allowed 'Trans proline' 0 C--N 1.367 1.51 0 C-N-CA 122.602 2.201 . . . . 0.0 115.577 177.129 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -82.96 109.28 1.69 Allowed 'Trans proline' 0 CA--C 1.539 0.75 0 N-CA-C 105.931 -2.373 . . . . 0.0 105.931 175.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.461 HG12 ' HD2' ' B' ' 6' ' ' PRO . 2.5 t -49.1 148.05 4.48 Favored Pre-proline 0 CA--C 1.56 1.353 0 CA-C-N 113.563 -1.653 . . . . 0.0 111.802 -177.637 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 6' ' ' PRO . . . . . 0.461 ' HD2' HG12 ' B' ' 5' ' ' VAL . 26.8 Cg_exo -67.3 153.98 75.46 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 123.06 2.506 . . . . 0.0 115.689 178.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -65.85 114.35 2.92 Favored 'Trans proline' 0 C--N 1.372 1.794 0 N-CA-C 107.106 -1.921 . . . . 0.0 107.106 175.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -95.25 93.42 7.28 Favored 'General case' 0 C--O 1.22 -0.482 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 151.95 79.05 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 O-C-N 125.776 1.923 . . . . 0.0 108.719 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.27 73.72 3.85 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 111.52 -2.582 . . . . 0.0 110.987 178.47 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.006 0 CA-C-N 115.198 -0.91 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.744 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . . . . . . . . 0 N--CA 1.444 -0.733 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.411 ' H ' HG13 ' A' ' 53' ' ' ILE . 47.4 mm -143.7 116.37 3.03 Favored 'Isoleucine or valine' 0 C--N 1.349 0.574 0 CA-C-N 112.484 -2.143 . . . . 0.0 109.623 -175.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.424 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -68.27 125.89 27.84 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.185 177.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.1 mmmt -97.35 -26.0 15.03 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.002 -0.999 . . . . 0.0 113.055 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -142.08 168.28 20.11 Favored 'General case' 0 C--N 1.351 0.645 0 O-C-N 125.031 1.457 . . . . 0.0 107.847 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -68.98 145.43 53.6 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 113.591 -1.64 . . . . 0.0 109.129 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -146.95 128.92 15.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 116.946 -1.902 . . . . 0.0 111.166 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.2 mmtp -120.49 112.94 19.59 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 112.346 -2.207 . . . . 0.0 108.028 179.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.84 158.88 0.19 Allowed 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 123.408 1.575 . . . . 0.0 113.938 -177.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.1 p -114.28 -22.47 9.91 Favored 'General case' 0 C--N 1.346 0.417 0 CA-C-N 110.719 -2.946 . . . . 0.0 112.258 -177.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -154.03 173.05 16.53 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 113.354 -1.748 . . . . 0.0 111.238 -177.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -54.96 -31.27 60.49 Favored 'General case' 0 CA--C 1.553 1.078 0 CA-C-N 110.278 -3.147 . . . . 0.0 114.478 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 55.0 p-10 -88.88 -2.7 58.72 Favored 'General case' 0 C--N 1.353 0.739 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -178.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -112.94 156.6 22.73 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.011 -1.45 . . . . 0.0 108.552 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.42 HD23 ' C ' ' A' ' 45' ' ' ASP . 2.8 pp -135.04 152.38 51.64 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 111.994 -2.366 . . . . 0.0 108.64 177.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . 0.281 57.7 m -82.23 170.88 14.91 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 112.013 -2.358 . . . . 0.0 112.462 -177.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -163.81 -176.58 4.67 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 108.709 -3.86 . . . . 0.0 106.501 172.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.27 144.54 36.51 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.87 102.16 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.247 0 O-C-N 125.068 1.48 . . . . 0.0 112.514 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.424 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 136.25 -24.03 3.27 Favored Glycine 0 C--N 1.355 1.635 0 CA-C-N 115.016 -0.993 . . . . 0.0 114.584 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.402 ' HB3' HD21 ' A' ' 41' ' ' LEU . 4.1 m-20 -50.49 142.48 10.55 Favored 'General case' 0 C--N 1.359 1.01 0 CA-C-O 122.8 1.286 . . . . 0.0 114.2 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.7 mm -99.0 116.67 42.65 Favored 'Isoleucine or valine' 0 C--N 1.348 0.533 0 N-CA-C 102.156 -3.276 . . . . 0.0 102.156 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.744 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 3.1 mp -107.2 155.04 20.35 Favored 'General case' 0 C--N 1.349 0.545 0 O-C-N 124.606 1.191 . . . . 0.0 111.547 -176.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.63 110.92 23.01 Favored 'General case' 0 C--N 1.355 0.807 0 CA-C-N 111.343 -2.662 . . . . 0.0 108.854 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.603 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 58.9 t -87.42 106.96 16.67 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 C-N-CA 116.915 -1.914 . . . . 0.0 110.016 -176.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.7 tp . . . . . 0 CA--C 1.546 0.794 0 CA-C-N 112.148 -2.296 . . . . 0.0 107.516 179.212 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 49.5 m-20 . . . . . 0 CA--C 1.552 1.039 0 CA-C-O 118.269 -0.872 . . . . 0.0 113.212 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -140.26 166.41 24.75 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.776 0.798 . . . . 0.0 112.346 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -142.22 146.17 34.89 Favored 'General case' 0 C--N 1.357 0.923 0 CA-C-N 113.228 -1.806 . . . . 0.0 109.648 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.9 tttt -101.54 118.99 38.08 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 175.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.27 172.11 13.13 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 119.101 -1.04 . . . . 0.0 111.841 -177.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -109.77 136.23 49.42 Favored 'General case' 0 C--N 1.36 1.036 0 CA-C-N 114.128 -1.396 . . . . 0.0 111.227 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.402 HD21 ' HB3' ' A' ' 23' ' ' ASP 0.283 11.2 mt -160.13 136.02 8.49 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-N 111.755 -2.475 . . . . 0.0 114.611 179.477 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 57.3 21.49 6.77 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 110.731 -2.94 . . . . 0.0 116.32 170.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 94.74 10.7 57.56 Favored Glycine 0 CA--C 1.538 1.489 0 O-C-N 124.299 0.999 . . . . 0.0 113.557 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -132.01 169.42 16.36 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-O 122.137 0.97 . . . . 0.0 108.939 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.42 ' C ' HD23 ' A' ' 17' ' ' LEU . 8.7 p-10 -141.51 129.82 22.34 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 112.37 -2.196 . . . . 0.0 107.51 179.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.07 -179.96 43.32 Favored Glycine 0 C--N 1.348 1.244 0 C-N-CA 118.768 -1.682 . . . . 0.0 111.842 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -77.52 146.34 36.42 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 113.121 -1.539 . . . . 0.0 110.825 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.741 HD13 HD22 ' A' ' 25' ' ' LEU . 2.6 pt -142.83 144.26 28.86 Favored Pre-proline 0 CA--C 1.542 0.666 0 CA-C-N 111.125 -2.761 . . . . 0.0 106.843 179.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -79.2 145.79 19.45 Favored 'Trans proline' 0 C--N 1.364 1.377 0 N-CA-C 115.417 1.276 . . . . 0.0 115.417 -178.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -67.37 -44.24 79.43 Favored 'General case' 0 C--N 1.358 0.958 0 CA-C-N 113.996 -1.456 . . . . 0.0 111.568 -177.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.292 0.7 OUTLIER -67.36 -10.21 48.88 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 116.794 -1.962 . . . . 0.0 114.255 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -93.62 -10.2 35.44 Favored 'General case' 0 C--N 1.359 1.003 0 CA-C-O 118.417 -0.802 . . . . 0.0 111.474 176.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.677 ' CD1' ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -131.07 175.12 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-O 122.93 1.347 . . . . 0.0 110.088 179.864 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.516 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 33.3 tt0 -135.67 133.79 38.52 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 111.931 -2.395 . . . . 0.0 106.666 176.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 5.5 mtm . . . . . 0 C--N 1.348 0.522 0 CA-C-N 114.55 -1.205 . . . . 0.0 109.481 178.635 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo . . . . . 0 N--CA 1.446 -1.27 0 N-CA-C 115.069 1.142 . . . . 0.0 115.069 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -55.84 159.67 11.31 Favored 'Trans proline' 0 C--N 1.365 1.439 0 C-N-CA 122.453 2.102 . . . . 0.0 116.813 177.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -72.13 127.29 12.61 Favored 'Trans proline' 0 C--N 1.365 1.4 0 N-CA-C 105.822 -2.415 . . . . 0.0 105.822 173.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.452 HG12 ' HD2' ' B' ' 6' ' ' PRO . 3.0 t -71.33 149.55 94.02 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 118.107 -1.437 . . . . 0.0 109.438 -177.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' PRO . . . . . 0.452 ' HD2' HG12 ' B' ' 5' ' ' VAL . 15.7 Cg_exo -71.09 155.25 61.77 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 O-C-N 123.539 1.284 . . . . 0.0 114.797 178.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -70.54 123.42 9.83 Favored 'Trans proline' 0 CA--C 1.548 1.186 0 N-CA-C 106.306 -2.228 . . . . 0.0 106.306 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.352 0.705 0 C-N-CA 118.639 -1.224 . . . . 0.0 109.046 -179.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.703 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.449 -0.507 0 CA-C-O 122.17 0.986 . . . . 0.0 109.392 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.1 mt -147.0 116.17 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.646 0 CA-C-N 111.422 -2.626 . . . . 0.0 109.526 -178.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.27 129.51 40.13 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.747 177.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.0 mmmt -96.46 -23.67 16.47 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 113.797 -1.547 . . . . 0.0 113.291 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -141.92 168.81 18.88 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 125.203 1.564 . . . . 0.0 108.046 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -68.82 146.89 52.48 Favored 'General case' 0 C--N 1.357 0.892 0 CA-C-N 113.283 -1.781 . . . . 0.0 107.429 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -146.87 133.6 20.0 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 117.4 -1.72 . . . . 0.0 108.837 176.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm -122.08 112.17 17.91 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 113.88 -1.509 . . . . 0.0 107.056 177.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.9 154.63 0.7 Allowed 'General case' 0 C--N 1.381 1.943 0 CA-C-O 121.942 0.877 . . . . 0.0 112.639 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.9 p -113.26 -17.2 12.38 Favored 'General case' 0 C--N 1.36 1.035 0 CA-C-N 112.372 -2.195 . . . . 0.0 113.964 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.58 163.25 39.47 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 114.226 -1.352 . . . . 0.0 109.041 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -52.12 -30.63 27.19 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 110.709 -2.95 . . . . 0.0 115.008 -177.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 48.1 p-10 -87.97 -1.5 58.03 Favored 'General case' 0 C--N 1.358 0.971 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -177.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -109.1 160.04 16.38 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 113.835 -1.53 . . . . 0.0 108.125 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.601 HD12 ' O ' ' A' ' 18' ' ' SER . 0.4 OUTLIER -135.13 151.88 51.11 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 179.12 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.601 ' O ' HD12 ' A' ' 17' ' ' LEU . 25.9 m -83.04 168.27 17.09 Favored 'General case' 0 CA--C 1.56 1.365 0 CA-C-N 112.851 -1.977 . . . . 0.0 113.753 -178.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -164.08 -174.19 3.47 Favored 'General case' 0 C--N 1.354 0.766 0 CA-C-N 112.591 -2.095 . . . . 0.0 107.818 173.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.86 146.22 40.95 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 112.968 -1.924 . . . . 0.0 105.842 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -47.23 102.48 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.254 0 O-C-N 125.575 1.797 . . . . 0.0 111.537 178.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 127.05 -16.38 6.41 Favored Glycine 0 CA--C 1.541 1.678 0 CA-C-N 113.327 -1.76 . . . . 0.0 116.055 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -52.42 147.75 7.72 Favored 'General case' 0 C--N 1.365 1.255 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -177.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 88.0 mt -99.14 113.43 34.03 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 175.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.582 HD22 HD13 ' A' ' 48' ' ' ILE . 4.5 mp -107.71 160.05 16.01 Favored 'General case' 0 C--N 1.35 0.627 0 CA-C-O 122.86 1.314 . . . . 0.0 110.664 -178.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.4 ttmt -101.6 112.35 24.89 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 109.911 -3.313 . . . . 0.0 106.747 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.536 HG23 ' HB2' ' A' ' 3' ' ' ALA . 25.0 t -87.8 98.1 7.23 Favored 'Isoleucine or valine' 0 C--N 1.349 0.558 0 C-N-CA 113.058 -3.457 . . . . 0.0 108.494 -177.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.353 0.721 0 CA-C-N 112.587 -2.097 . . . . 0.0 107.185 177.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 . . . . . 0 N--CA 1.442 -0.855 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -137.97 153.94 49.4 Favored 'General case' 0 C--N 1.363 1.155 0 O-C-N 123.638 0.586 . . . . 0.0 109.997 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -130.61 151.54 50.96 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -100.72 122.17 42.91 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 178.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -143.53 168.13 20.59 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 118.736 -1.186 . . . . 0.0 113.61 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -111.59 135.16 52.55 Favored 'General case' 0 C--N 1.368 1.387 0 O-C-N 125.396 1.685 . . . . 0.0 111.13 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.572 ' HB2' HD11 ' A' ' 17' ' ' LEU 0.298 12.4 mt -162.97 143.77 9.55 Favored 'General case' 0 C--N 1.345 0.372 0 CA-C-N 110.695 -2.957 . . . . 0.0 113.93 177.773 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.58 29.62 18.71 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 110.479 -3.055 . . . . 0.0 115.501 170.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 75.77 18.61 79.57 Favored Glycine 0 CA--C 1.545 1.954 0 CA-C-N 114.434 -1.257 . . . . 0.0 114.088 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -138.93 171.38 14.42 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 124.828 1.251 . . . . 0.0 109.352 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -143.05 139.67 30.62 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 112.145 -2.298 . . . . 0.0 108.252 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.575 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -179.24 177.37 48.35 Favored Glycine 0 C--N 1.349 1.264 0 C-N-CA 118.977 -1.582 . . . . 0.0 112.386 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -77.68 145.92 36.34 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-N 113.311 -1.445 . . . . 0.0 110.164 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.582 HD13 HD22 ' A' ' 25' ' ' LEU . 1.6 pt -141.79 144.78 34.1 Favored Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 111.961 -2.381 . . . . 0.0 107.56 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -76.7 149.58 30.16 Favored 'Trans proline' 0 C--N 1.369 1.629 0 N-CA-C 116.028 1.511 . . . . 0.0 116.028 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.15 -49.26 62.14 Favored 'General case' 0 C--N 1.353 0.732 0 CA-C-N 112.718 -2.037 . . . . 0.0 111.434 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.253 0.7 OUTLIER -65.54 -7.58 15.33 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 117.08 -1.848 . . . . 0.0 115.92 -179.307 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.406 ' CE1' HG22 ' B' ' 5' ' ' VAL . 8.4 m-85 -93.04 -11.1 33.89 Favored 'General case' 0 C--N 1.358 0.97 0 CA-C-O 118.34 -0.838 . . . . 0.0 112.495 177.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.703 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -128.06 170.32 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-O 122.346 1.07 . . . . 0.0 108.82 178.52 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.469 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 17.7 tt0 -128.46 132.96 48.42 Favored 'General case' 0 C--N 1.354 0.775 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.532 0.265 0 CA-C-N 112.437 -2.165 . . . . 0.0 111.036 -179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 CA--C 1.553 1.471 0 N-CA-C 117.245 1.979 . . . . 0.0 117.245 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -59.21 160.31 19.68 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 124.341 3.361 . . . . 0.0 117.01 177.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -76.17 118.9 5.12 Favored 'Trans proline' 0 C--N 1.368 1.563 0 N-CA-C 106.314 -2.226 . . . . 0.0 106.314 174.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.445 HG12 ' HD2' ' B' ' 6' ' ' PRO . 3.1 t -62.73 147.35 93.37 Favored Pre-proline 0 CA--C 1.538 0.515 0 CA-C-N 113.001 -1.909 . . . . 0.0 109.739 -178.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' PRO . . . . . 0.445 ' HD2' HG12 ' B' ' 5' ' ' VAL . 18.1 Cg_exo -66.66 157.41 61.06 Favored 'Trans proline' 0 C--N 1.359 1.097 0 O-C-N 123.137 1.072 . . . . 0.0 114.468 178.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -67.69 120.88 7.9 Favored 'Trans proline' 0 C--N 1.365 1.411 0 N-CA-C 105.904 -2.383 . . . . 0.0 105.904 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.357 0.928 0 O-C-N 124.492 1.12 . . . . 0.0 110.778 -178.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.703 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.452 -0.347 0 CA-C-O 121.779 0.8 . . . . 0.0 109.362 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.1 mt -149.03 120.03 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.635 0 CA-C-N 112.297 -2.229 . . . . 0.0 108.745 -177.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 128.38 36.35 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.602 -1.635 . . . . 0.0 111.883 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.45 -24.77 15.95 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 114.42 -1.263 . . . . 0.0 113.315 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -139.89 167.61 21.72 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 118.946 -1.102 . . . . 0.0 108.781 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -67.61 145.98 54.31 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 113.725 -1.579 . . . . 0.0 108.135 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -146.66 136.5 23.27 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 122.6 1.191 . . . . 0.0 109.591 176.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.13 106.57 9.66 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 112.776 -2.011 . . . . 0.0 108.003 178.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.11 157.97 0.16 Allowed 'General case' 0 C--N 1.36 1.023 0 CA-C-O 122.631 1.205 . . . . 0.0 113.753 -178.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.9 p -112.84 -17.96 12.39 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 110.942 -2.845 . . . . 0.0 112.054 -177.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.71 169.02 24.34 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 123.071 1.415 . . . . 0.0 111.812 -176.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -50.53 -36.36 33.89 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 110.59 -3.004 . . . . 0.0 112.913 -179.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 39.3 p30 -87.38 -1.4 57.9 Favored 'General case' 0 C--N 1.356 0.851 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -107.69 157.75 17.84 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 124.368 1.042 . . . . 0.0 108.419 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.605 HD23 ' N ' ' A' ' 46' ' ' GLY . 0.3 OUTLIER -132.74 155.12 49.45 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 114.047 -1.433 . . . . 0.0 107.187 178.621 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.59 ' O ' HD12 ' A' ' 17' ' ' LEU . 4.8 m -84.3 171.5 12.65 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 123.661 1.696 . . . . 0.0 114.055 -178.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -167.43 163.62 14.98 Favored 'General case' 0 C--N 1.347 0.465 0 CA-C-N 111.364 -2.653 . . . . 0.0 107.976 174.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -127.39 141.06 51.79 Favored 'General case' 0 C--O 1.223 -0.316 0 N-CA-C 105.45 -2.055 . . . . 0.0 105.45 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -40.81 99.63 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.061 0 O-C-N 125.986 2.054 . . . . 0.0 113.843 -176.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 129.55 -7.75 6.21 Favored Glycine 0 C--N 1.36 1.884 0 CA-C-N 113.562 -1.654 . . . . 0.0 116.115 178.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.573 ' HB3' HD21 ' A' ' 41' ' ' LEU . 11.2 m-20 -61.61 146.76 47.92 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 117.334 -1.746 . . . . 0.0 112.783 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 26.6 mm -99.08 112.85 32.3 Favored 'Isoleucine or valine' 0 C--N 1.347 0.474 0 N-CA-C 104.516 -2.401 . . . . 0.0 104.516 177.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.692 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 5.1 mp -107.16 160.92 15.21 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 118.301 -1.36 . . . . 0.0 111.693 -175.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.08 113.97 27.89 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 110.403 -3.089 . . . . 0.0 107.737 177.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.703 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 57.5 t -85.86 121.29 37.13 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 C-N-CA 116.486 -2.086 . . . . 0.0 106.885 -177.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 27.2 tp . . . . . 0 C--N 1.345 0.39 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.581 -175.961 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.6 m120 . . . . . 0 CA--C 1.551 0.99 0 CA-C-O 118.448 -0.787 . . . . 0.0 111.554 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.8 m95 -136.91 153.28 50.78 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -178.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -127.02 147.97 50.13 Favored 'General case' 0 C--N 1.355 0.846 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 178.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -102.03 116.28 32.35 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 104.133 -2.544 . . . . 0.0 104.133 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.38 173.74 11.29 Favored 'General case' 0 C--N 1.349 0.574 0 C-N-CA 119.086 -1.046 . . . . 0.0 111.154 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -109.26 141.83 41.0 Favored 'General case' 0 C--N 1.359 1.003 0 O-C-N 125.64 1.837 . . . . 0.0 110.675 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.573 HD21 ' HB3' ' A' ' 23' ' ' ASP . 8.3 mt -158.66 119.47 3.33 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 110.575 -3.011 . . . . 0.0 115.76 179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.367 0.0 OUTLIER 61.87 33.17 17.74 Favored 'General case' 0 C--N 1.384 2.092 1 C-N-CA 110.051 -4.66 . . . . 0.0 118.564 173.671 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.62 22.39 59.28 Favored Glycine 0 CA--C 1.546 2.022 0 C-N-CA 116.227 -2.892 . . . . 0.0 112.384 -178.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.45 137.22 47.18 Favored 'General case' 0 C--N 1.353 0.72 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 179.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 18.4 p-10 -130.17 145.77 51.75 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 -178.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.605 ' N ' HD23 ' A' ' 17' ' ' LEU . . . 176.19 178.79 46.25 Favored Glycine 0 C--N 1.34 0.769 0 C-N-CA 116.313 -2.851 . . . . 0.0 112.388 -178.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -76.93 143.03 39.82 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-O 123.414 1.578 . . . . 0.0 109.331 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.2 pt -143.37 144.19 27.12 Favored Pre-proline 0 C--O 1.218 -0.556 0 CA-C-N 111.412 -2.631 . . . . 0.0 106.195 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -77.09 147.53 26.58 Favored 'Trans proline' 0 C--N 1.356 0.968 0 N-CA-C 116.237 1.591 . . . . 0.0 116.237 -177.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.14 -45.76 66.14 Favored 'General case' 0 C--N 1.358 0.938 0 C-N-CA 116.922 -1.911 . . . . 0.0 110.843 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.313 0.5 OUTLIER -62.6 -7.38 4.64 Favored 'General case' 0 CA--C 1.557 1.235 0 C-N-CA 115.137 -2.625 . . . . 0.0 115.617 -177.838 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.704 ' CE1' HG22 ' B' ' 5' ' ' VAL . 6.8 m-85 -93.42 -10.52 34.86 Favored 'General case' 0 CA--C 1.559 1.302 0 CA-C-O 118.738 -0.648 . . . . 0.0 111.611 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.703 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -127.3 168.85 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-O 122.314 1.054 . . . . 0.0 108.707 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.433 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 3.5 tt0 -120.94 136.66 54.91 Favored 'General case' 0 C--N 1.352 0.694 0 N-CA-C 103.11 -2.922 . . . . 0.0 103.11 176.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.224 -0.248 0 CA-C-N 113.233 -1.803 . . . . 0.0 110.212 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.436 -1.91 0 N-CA-C 115.563 1.332 . . . . 0.0 115.563 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -58.95 158.41 25.17 Favored 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 122.36 2.04 . . . . 0.0 115.89 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -70.14 119.57 6.47 Favored 'Trans proline' 0 C--N 1.362 1.271 0 N-CA-C 106.07 -2.319 . . . . 0.0 106.07 175.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.704 HG22 ' CE1' ' A' ' 52' ' ' TYR . 16.6 t -64.63 149.34 95.76 Favored Pre-proline 0 CA--C 1.543 0.7 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.995 -177.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' PRO . . . . . 0.403 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 20.2 Cg_exo -66.05 158.66 53.22 Favored 'Trans proline' 0 C--N 1.362 1.256 0 O-C-N 123.052 1.027 . . . . 0.0 114.361 178.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -78.89 118.52 4.12 Favored 'Trans proline' 0 C--N 1.358 1.027 0 N-CA-C 106.549 -2.135 . . . . 0.0 106.549 176.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.352 0.694 0 C-N-CA 117.287 -1.765 . . . . 0.0 109.2 -179.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.629 ' HB2' ' CG2' ' A' ' 27' ' ' VAL . . . . . . . . 0 N--CA 1.449 -0.491 0 CA-C-O 122.935 1.35 . . . . 0.0 108.68 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.275 16.4 mm -145.47 118.39 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-N 110.587 -3.006 . . . . 0.0 108.888 -176.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.552 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -68.45 125.54 26.81 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 117.054 -1.858 . . . . 0.0 107.83 176.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.8 mtmt -95.2 -24.89 16.61 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.519 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 52.2 m-85 -141.46 167.41 22.23 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -67.93 147.0 53.07 Favored 'General case' 0 C--N 1.352 0.698 0 CA-C-N 114.049 -1.432 . . . . 0.0 107.494 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -147.37 129.64 15.66 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 116.819 -1.952 . . . . 0.0 110.214 176.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.406 ' H ' ' HD3' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -121.5 116.42 24.66 Favored 'General case' 0 CA--C 1.569 1.687 0 CA-C-N 113.699 -1.591 . . . . 0.0 107.407 177.543 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.58 159.87 0.09 Allowed 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 123.537 1.637 . . . . 0.0 115.185 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 28.4 p -119.14 -15.64 9.19 Favored 'General case' 0 C--N 1.353 0.751 0 CA-C-N 110.162 -3.199 . . . . 0.0 114.057 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.09 160.45 43.43 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 123.052 1.406 . . . . 0.0 111.443 -178.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -49.28 -32.2 10.42 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-N 111.066 -2.788 . . . . 0.0 113.462 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -89.32 -2.16 58.34 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.988 1.847 . . . . 0.0 115.988 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -106.89 162.82 13.48 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 114.051 -1.432 . . . . 0.0 107.761 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.637 HD12 ' O ' ' A' ' 18' ' ' SER . 0.4 OUTLIER -134.58 152.4 51.75 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.058 -1.428 . . . . 0.0 107.824 179.443 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.637 ' O ' HD12 ' A' ' 17' ' ' LEU . 4.2 m -85.0 164.76 18.07 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 124.31 2.005 . . . . 0.0 113.048 -178.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -162.16 178.59 8.63 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 111.431 -2.622 . . . . 0.0 108.168 173.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.19 145.98 44.35 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 111.853 -2.431 . . . . 0.0 104.723 -178.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -47.48 100.43 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 O-C-N 125.69 1.869 . . . . 0.0 112.191 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.552 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 130.59 -14.7 5.54 Favored Glycine 0 C--N 1.353 1.482 0 CA-C-O 118.634 -1.092 . . . . 0.0 115.548 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.684 ' HB3' HD21 ' A' ' 41' ' ' LEU . 37.5 m-20 -53.71 146.09 14.19 Favored 'General case' 0 C--N 1.365 1.269 0 C-N-CA 118.746 -1.182 . . . . 0.0 112.289 -179.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.3 mm -95.6 116.45 37.28 Favored 'Isoleucine or valine' 0 C--N 1.352 0.688 0 N-CA-C 100.876 -3.75 . . . . 0.0 100.876 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.596 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 0.6 OUTLIER -106.61 153.19 22.72 Favored 'General case' 0 C--N 1.348 0.52 0 CA-C-N 113.174 -1.83 . . . . 0.0 111.363 -175.345 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -104.58 109.06 20.81 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 109.798 -3.364 . . . . 0.0 109.288 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.629 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 55.8 t -86.92 110.31 20.18 Favored 'Isoleucine or valine' 0 C--N 1.344 0.356 0 C-N-CA 116.687 -2.005 . . . . 0.0 110.065 -176.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.2 tp . . . . . 0 CA--C 1.551 0.984 0 CA-C-N 112.792 -2.003 . . . . 0.0 109.325 179.903 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 . . . . . 0 N--CA 1.436 -1.135 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -135.21 159.27 42.07 Favored 'General case' 0 CA--C 1.553 1.069 0 O-C-N 124.82 1.325 . . . . 0.0 109.218 -179.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -134.96 148.23 49.96 Favored 'General case' 0 C--N 1.354 0.78 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.5 ttpp -99.89 117.92 35.22 Favored 'General case' 0 C--N 1.354 0.799 0 N-CA-C 104.442 -2.429 . . . . 0.0 104.442 177.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.48 176.84 8.38 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 113.815 -1.539 . . . . 0.0 111.061 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -126.61 143.79 51.11 Favored 'General case' 0 C--N 1.356 0.871 0 O-C-N 125.33 1.644 . . . . 0.0 110.856 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.684 HD21 ' HB3' ' A' ' 23' ' ' ASP 0.289 10.8 mt -161.9 142.62 10.61 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 109.766 -3.379 . . . . 0.0 113.084 178.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.94 30.3 18.93 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 111.544 -2.571 . . . . 0.0 116.352 170.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.95 11.61 85.23 Favored Glycine 0 CA--C 1.545 1.95 0 C-N-CA 119.305 -1.426 . . . . 0.0 114.975 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -136.08 165.24 26.16 Favored 'General case' 0 C--N 1.352 0.689 0 C-N-CA 124.448 1.099 . . . . 0.0 108.055 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -139.44 139.06 36.96 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 112.84 -1.982 . . . . 0.0 108.011 -179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.535 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -172.48 178.26 44.67 Favored Glycine 0 C--N 1.344 0.988 0 C-N-CA 118.105 -1.998 . . . . 0.0 111.707 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -77.78 146.0 36.09 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 112.628 -1.786 . . . . 0.0 110.369 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.537 HD13 HD22 ' A' ' 25' ' ' LEU . 35.0 pt -141.88 143.27 27.95 Favored Pre-proline 0 C--N 1.349 0.551 0 CA-C-N 112.128 -2.306 . . . . 0.0 106.023 178.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -75.1 139.42 24.0 Favored 'Trans proline' 0 C--N 1.362 1.273 0 CA-C-N 118.972 0.669 . . . . 0.0 112.664 -178.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.7 pttp -70.05 -21.13 63.2 Favored 'General case' 0 C--N 1.358 0.974 0 C-N-CA 114.761 -2.776 . . . . 0.0 112.978 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.62 -18.9 61.55 Favored 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 113.544 -3.262 . . . . 0.0 111.329 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -87.54 -6.87 58.15 Favored 'General case' 0 C--N 1.367 1.358 0 O-C-N 123.851 0.719 . . . . 0.0 112.528 -175.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.605 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -129.76 172.28 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 CA-C-O 121.893 0.854 . . . . 0.0 108.827 177.75 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.459 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 2.4 tt0 -132.87 136.22 46.08 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 112.848 -1.978 . . . . 0.0 105.938 177.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 55.2 mtm . . . . . 0 CA--C 1.538 0.506 0 CA-C-N 112.721 -2.036 . . . . 0.0 110.736 -179.18 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . 0.519 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 1.9 Cg_endo . . . . . 0 CA--C 1.564 2.013 0 N-CA-C 115.007 1.118 . . . . 0.0 115.007 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' B' ' 2' ' ' PRO . 75.2 Cg_exo -57.69 158.12 21.16 Favored 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 124.056 3.17 . . . . 0.0 117.627 179.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -71.61 114.05 3.83 Favored 'Trans proline' 0 C--N 1.357 0.989 0 N-CA-C 106.885 -2.006 . . . . 0.0 106.885 175.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.434 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.1 t -54.58 148.27 26.25 Favored Pre-proline 0 C--N 1.354 0.782 0 CA-C-N 113.473 -1.694 . . . . 0.0 109.864 -178.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' PRO . . . . . 0.434 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 21.0 Cg_exo -64.38 153.83 74.7 Favored 'Trans proline' 0 C--N 1.359 1.129 0 N-CA-C 114.977 1.107 . . . . 0.0 114.977 178.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -76.63 111.05 3.17 Favored 'Trans proline' 0 C--N 1.362 1.242 0 N-CA-C 107.462 -1.784 . . . . 0.0 107.462 176.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? . . . . . 0 C--N 1.349 0.544 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.395 -179.476 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.959 ' HB1' HD11 ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.451 -0.422 0 N-CA-C 105.287 -2.116 . . . . 0.0 105.287 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 mt -154.43 134.35 3.97 Favored 'Isoleucine or valine' 0 C--N 1.348 0.508 0 C-N-CA 117.553 -1.659 . . . . 0.0 109.59 -175.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.526 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -66.92 129.45 39.94 Favored 'General case' 0 CA--C 1.557 1.214 0 CA-C-N 112.504 -2.135 . . . . 0.0 109.596 177.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -97.44 -27.19 14.56 Favored 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 113.839 -1.528 . . . . 0.0 111.954 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.422 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 65.0 m-85 -142.44 170.46 15.66 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 113.32 -1.763 . . . . 0.0 106.956 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.32 142.87 47.1 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 118.807 -1.157 . . . . 0.0 108.413 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -147.18 127.17 13.63 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 117.418 -1.713 . . . . 0.0 111.225 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.94 118.78 33.9 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 112.763 -2.017 . . . . 0.0 108.142 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.85 151.53 1.2 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 122.181 0.991 . . . . 0.0 112.216 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.79 -11.0 9.06 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-N 112.06 -2.336 . . . . 0.0 112.126 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.43 164.99 37.21 Favored 'General case' 0 C--N 1.356 0.885 0 CA-C-O 123.847 1.784 . . . . 0.0 110.338 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -47.77 -34.67 8.81 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 108.842 -3.799 . . . . 0.0 114.697 -178.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -93.87 0.68 56.31 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 26.7 mp0 -112.97 154.55 26.27 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.399 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.441 HD23 ' C ' ' A' ' 45' ' ' ASP . 1.9 pp -134.54 154.92 51.22 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 112.807 -1.997 . . . . 0.0 109.854 177.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . 0.255 58.5 m -82.1 166.7 19.48 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 111.213 -2.721 . . . . 0.0 113.143 -177.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.9 p90 -163.9 -175.95 4.32 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 110.248 -3.16 . . . . 0.0 107.419 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.8 143.82 37.05 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 111.918 -2.401 . . . . 0.0 105.509 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -46.67 98.57 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.441 0 O-C-N 125.168 1.543 . . . . 0.0 112.866 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.526 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 131.11 -13.28 5.5 Favored Glycine 0 C--N 1.356 1.66 0 O-C-N 124.525 1.14 . . . . 0.0 115.535 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.457 ' HB3' HD21 ' A' ' 41' ' ' LEU . 1.8 m-20 -54.52 145.77 17.8 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 119.109 -1.037 . . . . 0.0 112.684 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.8 mm -97.0 117.0 40.74 Favored 'Isoleucine or valine' 0 C--N 1.352 0.686 0 N-CA-C 103.09 -2.93 . . . . 0.0 103.09 177.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.464 HD21 ' CD1' ' A' ' 41' ' ' LEU . 0.6 OUTLIER -111.04 148.48 32.52 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 112.173 -2.285 . . . . 0.0 112.542 -175.714 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.14 107.54 18.56 Favored 'General case' 0 C--O 1.213 -0.832 0 CA-C-N 110.705 -2.952 . . . . 0.0 108.475 178.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.414 HG13 ' CB ' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -86.34 99.0 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 C-N-CA 115.133 -2.627 . . . . 0.0 109.778 -176.814 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.1 tp . . . . . 0 C--N 1.344 0.357 0 CA-C-N 110.509 -3.041 . . . . 0.0 107.292 178.824 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 19.9 m120 . . . . . 0 N--CA 1.436 -1.125 0 N-CA-C 115.288 1.588 . . . . 0.0 115.288 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.432 ' CE2' ' HB3' ' B' ' 8' ' ' ARG . 70.5 m95 -132.55 153.98 50.44 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 119.053 0.842 . . . . 0.0 110.929 -178.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.436 ' O ' ' HA ' ' A' ' 47' ' ' PHE 0.261 21.4 m-85 -133.46 148.51 51.74 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 114.595 -1.184 . . . . 0.0 108.514 177.634 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -99.19 119.35 37.72 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 179.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.04 172.54 12.54 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 119.181 -1.008 . . . . 0.0 112.162 -176.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -113.7 134.39 54.78 Favored 'General case' 0 C--N 1.362 1.139 0 O-C-N 125.15 1.531 . . . . 0.0 111.915 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.464 ' CD1' HD21 ' A' ' 25' ' ' LEU 0.342 9.4 mt -161.2 137.55 8.35 Favored 'General case' 0 C--N 1.355 0.813 0 CA-C-N 111.662 -2.517 . . . . 0.0 114.565 178.778 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.9 21.14 5.85 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 110.218 -3.174 . . . . 0.0 116.661 170.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 91.96 15.22 54.87 Favored Glycine 0 C--N 1.353 1.486 0 CA-C-N 114.359 -1.292 . . . . 0.0 113.287 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -134.3 166.74 22.11 Favored 'General case' 0 C--N 1.354 0.773 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.441 ' C ' HD23 ' A' ' 17' ' ' LEU . 5.6 p-10 -141.96 129.64 21.56 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 112.773 -2.012 . . . . 0.0 107.546 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.49 178.56 44.53 Favored Glycine 0 C--N 1.353 1.493 0 C-N-CA 119.318 -1.42 . . . . 0.0 111.995 -177.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . 0.436 ' HA ' ' O ' ' A' ' 37' ' ' TYR . 69.3 m-85 -77.86 146.28 35.77 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 123.062 1.411 . . . . 0.0 113.481 -178.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.2 pt -141.18 144.15 33.54 Favored Pre-proline 0 C--N 1.354 0.788 0 CA-C-N 111.21 -2.723 . . . . 0.0 107.104 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.13 150.49 37.7 Favored 'Trans proline' 0 C--N 1.364 1.383 0 N-CA-C 116.327 1.626 . . . . 0.0 116.327 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . 0.342 0.1 OUTLIER -65.97 -45.39 81.87 Favored 'General case' 0 C--N 1.364 1.227 0 CA-C-N 114.043 -1.435 . . . . 0.0 111.446 179.622 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.319 0.7 OUTLIER -68.66 -11.89 60.7 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 116.116 -2.234 . . . . 0.0 114.306 -178.534 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.445 ' CE1' HG22 ' B' ' 5' ' ' VAL . 9.2 m-85 -92.44 -12.56 31.79 Favored 'General case' 0 C--N 1.357 0.924 0 CA-C-O 117.754 -1.117 . . . . 0.0 112.374 177.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.959 HD11 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -133.14 168.67 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-O 122.303 1.049 . . . . 0.0 109.2 178.925 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.456 ' N ' HG13 ' A' ' 53' ' ' ILE . 2.0 tt0 -136.92 137.63 39.78 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 113.185 -1.825 . . . . 0.0 107.823 176.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.2 mtm . . . . . 0 C--N 1.349 0.579 0 CA-C-N 113.707 -1.588 . . . . 0.0 109.072 178.78 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . 0.422 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 5.8 Cg_exo . . . . . 0 N--CA 1.445 -1.365 0 N-CA-C 114.337 0.86 . . . . 0.0 114.337 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -51.83 160.19 3.08 Favored 'Trans proline' 0 C--N 1.364 1.379 0 C-N-CA 122.652 2.235 . . . . 0.0 116.999 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -72.97 126.73 11.5 Favored 'Trans proline' 0 C--N 1.367 1.525 0 N-CA-C 105.762 -2.438 . . . . 0.0 105.762 175.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.445 HG22 ' CE1' ' A' ' 52' ' ' TYR . 10.7 t -70.74 146.71 93.8 Favored Pre-proline 0 CA--C 1.54 0.584 0 C-N-CA 117.688 -1.605 . . . . 0.0 108.92 -177.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' PRO . . . . . 0.416 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 12.5 Cg_exo -67.9 160.08 50.02 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 O-C-N 123.358 1.188 . . . . 0.0 114.806 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -78.57 116.54 3.83 Favored 'Trans proline' 0 CA--C 1.551 1.329 0 N-CA-C 108.405 -1.421 . . . . 0.0 108.405 176.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.432 ' HB3' ' CE2' ' A' ' 36' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--N 1.352 0.686 0 CA-C-N 114.304 -1.316 . . . . 0.0 108.865 179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.641 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.444 -0.769 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.1 mt -148.98 120.93 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 111.381 -2.645 . . . . 0.0 108.23 -176.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.96 134.08 49.05 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 113.325 -1.761 . . . . 0.0 108.401 176.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt -94.22 -22.3 18.5 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 124.415 1.086 . . . . 0.0 112.563 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.429 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 88.0 m-85 -142.33 170.29 15.98 Favored 'General case' 0 C--N 1.35 0.611 0 CA-C-N 113.935 -1.484 . . . . 0.0 108.394 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -72.51 149.29 44.24 Favored 'General case' 0 C--O 1.214 -0.8 0 CA-C-N 113.348 -1.751 . . . . 0.0 108.017 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.443 ' HE1' HG21 ' B' ' 5' ' ' VAL . 26.6 t80 -145.95 134.61 22.23 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 117.693 -1.603 . . . . 0.0 109.409 176.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -122.37 101.25 7.39 Favored 'General case' 0 CA--C 1.561 1.373 0 CA-C-N 111.694 -2.503 . . . . 0.0 109.773 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.55 152.69 0.89 Allowed 'General case' 0 C--N 1.362 1.131 0 CA-C-O 122.123 0.963 . . . . 0.0 113.028 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.1 p -118.84 -11.81 9.7 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-N 111.848 -2.433 . . . . 0.0 113.156 -177.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.22 163.58 38.53 Favored 'General case' 0 C--N 1.355 0.809 0 CA-C-O 123.323 1.535 . . . . 0.0 110.201 -178.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -49.08 -31.35 7.75 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 110.332 -3.122 . . . . 0.0 115.343 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 57.4 p30 -90.74 -4.13 56.93 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -109.77 158.09 18.48 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 113.693 -1.594 . . . . 0.0 107.791 -179.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.576 HD12 ' O ' ' A' ' 18' ' ' SER . 0.4 OUTLIER -133.41 152.22 51.89 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 111.624 -2.535 . . . . 0.0 108.134 178.441 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.576 ' O ' HD12 ' A' ' 17' ' ' LEU . 13.3 m -82.94 166.09 19.16 Favored 'General case' 0 C--N 1.354 0.765 0 CA-C-N 112.516 -2.129 . . . . 0.0 112.65 -178.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -163.7 -175.21 4.02 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 111.145 -2.752 . . . . 0.0 107.646 172.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -139.37 147.31 41.33 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.93 100.72 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.031 0 O-C-N 125.269 1.605 . . . . 0.0 112.651 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 129.7 -19.01 5.34 Favored Glycine 0 C--N 1.353 1.476 0 CA-C-O 117.94 -1.478 . . . . 0.0 115.415 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.467 ' HB3' HD21 ' A' ' 41' ' ' LEU . 76.8 m-20 -47.73 149.93 1.15 Allowed 'General case' 0 C--N 1.366 1.325 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -177.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mm -97.14 112.65 29.63 Favored 'Isoleucine or valine' 0 C--N 1.35 0.59 0 N-CA-C 103.54 -2.763 . . . . 0.0 103.54 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.849 HD11 HD11 ' A' ' 41' ' ' LEU . 3.1 mp -108.79 146.47 33.55 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-N 114.083 -1.417 . . . . 0.0 111.992 -175.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.34 112.49 25.4 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-N 111.877 -2.419 . . . . 0.0 107.546 179.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.629 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 12.0 t -87.87 99.58 8.98 Favored 'Isoleucine or valine' 0 C--N 1.352 0.679 0 C-N-CA 114.015 -3.074 . . . . 0.0 110.954 -175.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.7 mm? . . . . . 0 C--N 1.358 0.938 0 CA-C-N 112.976 -1.92 . . . . 0.0 106.009 177.115 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 43.4 m-20 . . . . . 0 N--CA 1.442 -0.856 0 N-CA-C 113.884 1.068 . . . . 0.0 113.884 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -134.03 155.82 49.32 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -136.17 153.61 51.21 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 114.05 -1.432 . . . . 0.0 108.514 177.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.9 ttmt -100.69 123.45 44.91 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 106.525 -1.658 . . . . 0.0 106.525 177.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -142.05 173.44 11.52 Favored 'General case' 0 C--N 1.352 0.677 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.683 -178.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 50.8 tt0 -120.92 136.66 54.9 Favored 'General case' 0 C--N 1.367 1.339 0 O-C-N 124.939 1.399 . . . . 0.0 111.062 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.849 HD11 HD11 ' A' ' 25' ' ' LEU 0.264 12.3 mt -160.34 142.38 12.82 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 110.222 -3.172 . . . . 0.0 113.655 178.733 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.03 24.66 9.81 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 109.08 -3.691 . . . . 0.0 115.62 171.297 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.03 14.49 66.89 Favored Glycine 0 C--N 1.357 1.726 0 CA-C-N 114.64 -1.163 . . . . 0.0 113.867 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -134.35 168.13 19.47 Favored 'General case' 0 C--N 1.35 0.605 0 C-N-CA 125.013 1.325 . . . . 0.0 108.662 -179.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -139.49 141.51 37.35 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 112.401 -2.181 . . . . 0.0 107.74 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.568 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -177.91 177.95 48.42 Favored Glycine 0 C--N 1.348 1.227 0 C-N-CA 118.268 -1.92 . . . . 0.0 112.755 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -77.94 143.35 37.73 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 112.759 -1.72 . . . . 0.0 111.302 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.5 pt -141.89 143.39 28.4 Favored Pre-proline 0 C--N 1.351 0.662 0 CA-C-N 111.597 -2.547 . . . . 0.0 106.611 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -78.45 151.29 25.75 Favored 'Trans proline' 0 C--N 1.364 1.352 0 N-CA-C 116.775 1.798 . . . . 0.0 116.775 -177.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -44.12 81.93 Favored 'General case' 0 C--N 1.365 1.275 0 C-N-CA 118.159 -1.416 . . . . 0.0 112.002 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.323 0.7 OUTLIER -66.2 -10.77 44.89 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 116.263 -2.175 . . . . 0.0 115.839 -178.787 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.657 ' CE1' HG22 ' B' ' 5' ' ' VAL . 7.8 m-85 -93.96 -10.55 33.33 Favored 'General case' 0 C--N 1.357 0.923 0 CA-C-O 117.356 -1.307 . . . . 0.0 110.911 177.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.641 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -129.95 169.75 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 CA-C-O 123.071 1.415 . . . . 0.0 109.778 179.211 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.5 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 28.2 tt0 -135.35 133.51 38.84 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 111.179 -2.737 . . . . 0.0 106.198 177.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 38.0 mtp . . . . . 0 C--N 1.353 0.748 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.824 -179.699 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . 0.429 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 5.6 Cg_exo . . . . . 0 N--CA 1.443 -1.454 0 CA-C-O 121.543 0.56 . . . . 0.0 112.297 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -49.87 156.13 3.57 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.224 1.949 . . . . 0.0 115.846 178.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -70.43 128.06 14.9 Favored 'Trans proline' 0 C--N 1.365 1.435 0 N-CA-C 107.011 -1.957 . . . . 0.0 107.011 176.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.657 HG22 ' CE1' ' A' ' 52' ' ' TYR . 13.3 t -73.59 145.95 85.39 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-N 113.92 -1.491 . . . . 0.0 108.511 -177.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -64.35 158.47 48.82 Favored 'Trans proline' 0 C--N 1.358 1.072 0 O-C-N 123.3 1.158 . . . . 0.0 114.535 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.55 118.38 5.48 Favored 'Trans proline' 0 C--N 1.36 1.136 0 N-CA-C 108.453 -1.403 . . . . 0.0 108.453 176.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.353 0.733 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.515 ' HB1' ' CD1' ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.447 -0.598 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.26 20.8 mt -147.19 116.19 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-N 111.963 -2.38 . . . . 0.0 109.305 -176.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.627 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -68.85 123.29 20.57 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 118.333 -1.347 . . . . 0.0 108.301 176.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -95.77 -23.56 16.9 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -141.16 163.32 33.28 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 125.355 1.659 . . . . 0.0 106.996 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -65.08 147.01 54.25 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 113.509 -1.678 . . . . 0.0 109.354 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -144.3 136.89 26.79 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 117.38 -1.728 . . . . 0.0 109.662 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -123.97 102.52 7.81 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 112.748 -2.024 . . . . 0.0 110.192 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.62 152.63 0.92 Allowed 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.381 1.086 . . . . 0.0 112.222 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.9 p -114.65 -14.42 12.05 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 111.464 -2.607 . . . . 0.0 114.306 -177.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -150.77 167.52 27.17 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-O 123.326 1.536 . . . . 0.0 110.049 -177.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -54.74 -30.48 56.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 110.018 -3.265 . . . . 0.0 113.907 -178.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 59.3 p30 -91.96 -2.8 56.57 Favored 'General case' 0 C--N 1.353 0.741 0 N-CA-C 114.857 1.429 . . . . 0.0 114.857 -177.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -108.84 156.01 20.14 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 125.012 1.445 . . . . 0.0 108.411 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.642 HD23 ' N ' ' A' ' 46' ' ' GLY . 0.3 OUTLIER -135.35 152.73 51.73 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 113.66 -1.609 . . . . 0.0 107.146 179.071 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.525 ' O ' HD12 ' A' ' 17' ' ' LEU . 25.0 m -83.0 166.69 18.6 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 112.805 -1.998 . . . . 0.0 113.636 -178.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -164.04 174.25 11.57 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-N 112.4 -2.182 . . . . 0.0 107.887 174.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 11.5 pttt -139.48 122.44 16.69 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 113.191 -1.822 . . . . 0.0 108.497 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -19.43 64.95 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 129.931 3.292 . . . . 0.0 118.29 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.627 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 158.87 -12.49 0.21 Allowed Glycine 0 CA--C 1.528 0.858 0 CA-C-N 112.452 -2.158 . . . . 0.0 114.622 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.417 ' HB3' HD21 ' A' ' 41' ' ' LEU . 41.7 m-20 -50.48 147.56 4.42 Favored 'General case' 0 C--N 1.36 1.041 0 CA-C-O 122.52 1.153 . . . . 0.0 113.414 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 70.1 mt -97.35 108.55 21.78 Favored 'Isoleucine or valine' 0 C--N 1.35 0.605 0 N-CA-C 101.618 -3.475 . . . . 0.0 101.618 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.507 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 0.5 OUTLIER -108.22 157.29 18.46 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 111.683 -2.508 . . . . 0.0 111.57 -176.413 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -106.9 103.82 13.34 Favored 'General case' 0 C--O 1.215 -0.717 0 CA-C-N 110.508 -3.042 . . . . 0.0 109.639 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.416 HG23 ' HB2' ' A' ' 3' ' ' ALA . 2.3 t -85.52 113.15 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 C-N-CA 116.71 -1.996 . . . . 0.0 106.663 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.4 tp . . . . . 0 CA--C 1.553 1.08 0 CA-C-N 112.712 -2.04 . . . . 0.0 107.702 179.352 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 . . . . . 0 CA--C 1.545 0.764 0 N-CA-C 113.287 0.847 . . . . 0.0 113.287 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -136.25 155.76 49.64 Favored 'General case' 0 C--N 1.351 0.673 0 O-C-N 124.15 0.906 . . . . 0.0 108.57 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -136.29 149.7 48.56 Favored 'General case' 0 C--N 1.351 0.663 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 176.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -98.25 120.6 38.93 Favored 'General case' 0 C--N 1.347 0.487 0 N-CA-C 102.101 -3.296 . . . . 0.0 102.101 177.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.99 172.61 12.6 Favored 'General case' 0 C--N 1.348 0.524 0 C-N-CA 118.074 -1.45 . . . . 0.0 112.062 -175.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -125.6 142.04 51.71 Favored 'General case' 0 C--N 1.356 0.861 0 CA-C-N 112.532 -2.122 . . . . 0.0 112.104 -177.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.444 ' HB2' HD11 ' A' ' 17' ' ' LEU . 4.2 mt -158.88 125.17 4.56 Favored 'General case' 0 C--O 1.222 -0.371 1 CA-C-N 108.337 -4.029 . . . . 0.0 115.041 -179.573 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.341 0.0 OUTLIER 61.06 28.98 18.67 Favored 'General case' 0 C--N 1.358 0.943 0 N-CA-C 119.557 3.169 . . . . 0.0 119.557 171.18 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 68.67 22.97 75.53 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 119.694 -1.241 . . . . 0.0 111.909 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -131.08 142.37 50.27 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 111.126 -2.537 . . . . 0.0 105.37 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -139.67 140.7 36.95 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 113.31 -1.768 . . . . 0.0 107.589 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.642 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -177.19 176.84 48.23 Favored Glycine 0 C--N 1.346 1.089 0 C-N-CA 118.651 -1.738 . . . . 0.0 111.901 -179.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -77.92 141.99 38.69 Favored 'General case' 0 C--N 1.35 0.606 0 CA-C-N 112.732 -1.734 . . . . 0.0 109.057 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 22.9 pt -142.12 148.17 47.2 Favored Pre-proline 0 N--CA 1.45 -0.454 0 CA-C-N 110.903 -2.862 . . . . 0.0 106.033 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -77.68 138.29 16.93 Favored 'Trans proline' 0 C--N 1.363 1.337 0 N-CA-C 114.066 0.756 . . . . 0.0 114.066 -177.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -33.51 71.89 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 117.315 -1.754 . . . . 0.0 112.549 -177.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.32 0.6 OUTLIER -70.01 -8.45 49.22 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 116.833 -1.947 . . . . 0.0 114.133 179.092 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.419 ' CE1' HG22 ' B' ' 5' ' ' VAL . 6.0 m-85 -93.01 -13.19 29.01 Favored 'General case' 0 CA--C 1.559 1.308 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 176.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.515 ' CD1' ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -128.88 170.62 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 CA-C-O 122.572 1.177 . . . . 0.0 109.736 179.606 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.491 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 2.8 tp10 -123.66 145.19 49.14 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 103.732 -2.692 . . . . 0.0 103.732 176.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . 0.275 38.5 mtm . . . . . 0 C--N 1.342 0.266 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -176.279 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo . . . . . 0 CA--C 1.554 1.495 0 N-CA-C 114.204 0.809 . . . . 0.0 114.204 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -54.71 160.94 6.63 Favored 'Trans proline' 0 C--N 1.368 1.575 0 C-N-CA 123.358 2.705 . . . . 0.0 116.997 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -73.51 127.93 12.23 Favored 'Trans proline' 0 C--N 1.371 1.757 0 N-CA-C 105.561 -2.515 . . . . 0.0 105.561 174.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.487 HG12 ' HD2' ' B' ' 6' ' ' PRO . 2.7 t -73.19 147.22 87.79 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-N 114.026 -1.443 . . . . 0.0 108.868 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' PRO . . . . . 0.487 ' HD2' HG12 ' B' ' 5' ' ' VAL . 13.4 Cg_exo -67.49 156.29 66.73 Favored 'Trans proline' 0 N--CA 1.45 -1.073 0 N-CA-C 115.69 1.381 . . . . 0.0 115.69 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -65.78 123.1 10.88 Favored 'Trans proline' 0 C--N 1.365 1.438 0 N-CA-C 107.347 -1.828 . . . . 0.0 107.347 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.547 0.848 0 CA-C-O 122.989 1.376 . . . . 0.0 110.831 -177.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.608 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.443 -0.824 0 CA-C-O 123.057 1.408 . . . . 0.0 108.323 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.251 44.3 mt -146.99 115.49 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.848 0 CA-C-N 109.931 -3.304 . . . . 0.0 109.423 -176.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.57 125.16 25.65 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 176.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.2 mtmt -95.45 -23.56 17.07 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 114.591 -1.186 . . . . 0.0 113.635 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -140.75 169.06 18.34 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 107.057 -1.46 . . . . 0.0 107.057 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -68.94 150.79 47.32 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.89 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -147.64 130.65 16.27 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 116.712 -1.995 . . . . 0.0 109.476 175.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.07 103.2 8.15 Favored 'General case' 0 CA--C 1.556 1.198 0 N-CA-C 106.088 -1.819 . . . . 0.0 106.088 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.82 154.38 0.33 Allowed 'General case' 0 C--N 1.375 1.696 0 O-C-N 124.717 1.261 . . . . 0.0 113.787 -178.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.0 p -111.66 -15.52 13.43 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-N 111.772 -2.467 . . . . 0.0 112.167 -177.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.42 163.12 40.16 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 123.123 1.439 . . . . 0.0 110.052 -178.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -51.71 -34.24 37.93 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 110.733 -2.94 . . . . 0.0 115.263 -176.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -89.1 0.1 56.99 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 118.383 -1.327 . . . . 0.0 114.501 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.06 159.5 16.25 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 113.013 -1.903 . . . . 0.0 106.236 176.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.562 HD12 ' O ' ' A' ' 18' ' ' SER . 0.4 OUTLIER -136.68 155.41 49.91 Favored 'General case' 0 CA--C 1.562 1.428 0 C-N-CA 118.303 -1.359 . . . . 0.0 108.049 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.562 ' O ' HD12 ' A' ' 17' ' ' LEU . 15.8 m -83.67 163.78 20.08 Favored 'General case' 0 CA--C 1.568 1.645 0 CA-C-N 113.419 -1.719 . . . . 0.0 113.021 -177.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -164.71 172.7 12.73 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 111.074 -2.785 . . . . 0.0 107.457 173.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -132.65 151.64 51.9 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 104.621 -2.363 . . . . 0.0 104.621 178.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.5 ttp180 -46.89 104.48 0.05 Allowed 'General case' 0 CA--C 1.556 1.173 0 CA-C-N 112.994 -1.912 . . . . 0.0 112.381 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.32 -23.22 4.61 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-N 113.446 -1.706 . . . . 0.0 115.743 178.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.405 ' HB3' HD21 ' A' ' 41' ' ' LEU . 47.8 m-20 -48.57 147.65 2.4 Favored 'General case' 0 C--N 1.364 1.239 0 N-CA-C 116.274 1.953 . . . . 0.0 116.274 -177.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.2 mp -100.87 117.05 45.55 Favored 'Isoleucine or valine' 0 C--N 1.346 0.416 0 CA-C-N 111.772 -2.467 . . . . 0.0 104.922 176.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.693 HD22 HD13 ' A' ' 48' ' ' ILE . 4.6 mp -110.67 159.88 17.19 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 122.748 1.261 . . . . 0.0 112.707 -179.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.0 108.14 19.2 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-N 110.78 -2.918 . . . . 0.0 105.633 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.454 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 2.7 t -87.13 102.3 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 111.827 -3.949 . . . . 0.0 110.147 -174.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.9 tt . . . . . 0 CA--C 1.539 0.557 0 C-N-CA 117.4 -1.72 . . . . 0.0 106.904 -179.934 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.458 ' HA ' ' HG2' ' A' ' 50' ' ' LYS . 32.1 m-20 . . . . . 0 C--O 1.219 -0.55 0 CA-C-O 118.593 -0.718 . . . . 0.0 112.845 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -123.38 152.87 41.1 Favored 'General case' 0 CA--C 1.553 1.074 0 O-C-N 124.338 1.024 . . . . 0.0 109.389 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -134.21 144.64 48.57 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 104.992 -2.225 . . . . 0.0 104.992 177.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -101.18 124.7 47.29 Favored 'General case' 0 C--N 1.358 0.948 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 178.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -144.34 169.14 18.49 Favored 'General case' 0 C--N 1.357 0.911 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -109.6 136.16 49.42 Favored 'General case' 0 C--N 1.367 1.342 0 CA-C-N 113.79 -1.55 . . . . 0.0 111.338 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.533 ' HB2' HD11 ' A' ' 17' ' ' LEU 0.304 11.2 mt -162.49 139.76 8.12 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 110.297 -3.138 . . . . 0.0 113.577 177.575 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 58.39 28.94 17.52 Favored 'General case' 0 C--N 1.353 0.737 0 CA-C-N 110.829 -2.896 . . . . 0.0 115.48 169.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.07 18.19 78.87 Favored Glycine 0 CA--C 1.541 1.698 0 CA-C-N 114.647 -1.16 . . . . 0.0 114.199 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -137.37 166.56 23.52 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 124.593 1.157 . . . . 0.0 107.937 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -142.68 136.49 29.09 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 112.33 -2.214 . . . . 0.0 106.423 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.53 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -174.14 175.36 46.6 Favored Glycine 0 C--N 1.347 1.154 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.144 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -78.78 147.83 33.17 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 122.927 1.346 . . . . 0.0 110.25 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.693 HD13 HD22 ' A' ' 25' ' ' LEU . 9.0 pt -142.16 147.85 45.72 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-N 111.54 -2.573 . . . . 0.0 106.162 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -75.41 142.43 26.64 Favored 'Trans proline' 0 C--N 1.362 1.275 0 N-CA-C 114.498 0.922 . . . . 0.0 114.498 -177.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.458 ' HG2' ' HA ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -70.53 -30.92 67.79 Favored 'General case' 0 C--N 1.369 1.425 0 C-N-CA 113.345 -3.342 . . . . 0.0 113.493 -179.719 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -69.49 -9.54 54.2 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 116.161 -2.216 . . . . 0.0 114.726 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.43 ' CE1' HG22 ' B' ' 5' ' ' VAL . 7.5 m-85 -93.04 -12.0 31.67 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.346 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.608 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -128.62 171.66 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 178.359 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.482 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 85.5 tt0 -132.19 132.96 43.65 Favored 'General case' 0 C--N 1.355 0.817 0 CA-C-N 112.53 -2.123 . . . . 0.0 106.16 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.6 mpp? . . . . . 0 CA--C 1.537 0.467 0 CA-C-N 113.369 -1.741 . . . . 0.0 110.004 179.782 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . 0.431 ' HA ' ' HD3' ' B' ' 3' ' ' PRO . 2.8 Cg_endo . . . . . 0 N--CA 1.431 -2.156 0 N-CA-C 115.402 1.27 . . . . 0.0 115.402 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' B' ' 2' ' ' PRO . 38.5 Cg_exo -54.81 156.75 14.3 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.663 2.242 . . . . 0.0 117.03 179.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -69.54 123.45 10.18 Favored 'Trans proline' 0 C--N 1.365 1.407 0 N-CA-C 105.345 -2.598 . . . . 0.0 105.345 174.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.484 HG12 ' HD2' ' B' ' 6' ' ' PRO . 3.3 t -72.05 150.39 92.47 Favored Pre-proline 0 C--N 1.343 0.296 0 CA-C-N 113.619 -1.628 . . . . 0.0 108.665 -178.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' PRO . . . . . 0.484 ' HD2' HG12 ' B' ' 5' ' ' VAL . 19.5 Cg_exo -69.99 155.87 64.13 Favored 'Trans proline' 0 N--CA 1.445 -1.328 0 O-C-N 123.473 1.249 . . . . 0.0 112.297 176.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -72.52 118.29 5.52 Favored 'Trans proline' 0 CA--C 1.547 1.16 0 N-CA-C 107.253 -1.864 . . . . 0.0 107.253 175.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.351 0.659 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 178.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.897 ' HB1' HD11 ' A' ' 53' ' ' ILE . . . . . . . . 0 C--O 1.22 -0.466 0 CA-C-O 122.459 1.123 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.428 12.0 mt -149.61 130.81 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 111.336 -2.665 . . . . 0.0 111.949 -167.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.467 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -65.84 126.3 28.08 Favored 'General case' 0 CA--C 1.556 1.174 0 CA-C-N 113.589 -1.641 . . . . 0.0 108.742 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mmpt? -98.02 -28.03 13.96 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 114.047 -1.433 . . . . 0.0 114.155 -178.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.412 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 22.1 m-85 -141.38 166.05 25.82 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 106.168 -1.79 . . . . 0.0 106.168 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.88 147.8 52.76 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 124.338 1.024 . . . . 0.0 109.451 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -146.69 132.78 19.28 Favored 'General case' 0 C--N 1.354 0.798 0 C-N-CA 118.043 -1.463 . . . . 0.0 109.471 176.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.9 mmtm -122.29 113.07 18.92 Favored 'General case' 0 C--N 1.346 0.431 0 CA-C-N 113.712 -1.585 . . . . 0.0 107.603 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.03 149.98 0.84 Allowed 'General case' 0 C--N 1.359 1.01 0 O-C-N 125.639 1.837 . . . . 0.0 112.468 -177.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.4 p -113.68 -19.4 11.59 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 111.054 -2.794 . . . . 0.0 113.557 -177.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.81 167.79 27.87 Favored 'General case' 0 C--N 1.354 0.777 0 CA-C-O 123.776 1.751 . . . . 0.0 111.965 -178.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -43.02 -39.67 2.75 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 109.824 -3.353 . . . . 0.0 115.393 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 49.2 p-10 -87.74 -0.81 57.41 Favored 'General case' 0 C--N 1.349 0.573 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 -175.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -106.39 159.77 15.89 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.714 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.626 HD11 ' HB2' ' A' ' 41' ' ' LEU . 0.5 OUTLIER -129.06 150.5 50.44 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 112.017 -2.356 . . . . 0.0 106.213 179.513 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.551 ' O ' HD12 ' A' ' 17' ' ' LEU . 10.2 m -84.07 169.1 15.26 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 123.709 1.718 . . . . 0.0 113.721 -177.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -162.69 178.99 8.02 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-N 111.712 -2.495 . . . . 0.0 108.377 171.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt -139.33 135.18 33.5 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 103.836 -2.653 . . . . 0.0 103.836 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -42.28 97.95 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.779 0 O-C-N 125.555 1.784 . . . . 0.0 113.489 -177.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.467 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 138.31 -22.81 3.04 Favored Glycine 0 C--N 1.35 1.344 0 CA-C-N 113.209 -1.814 . . . . 0.0 115.33 178.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.619 ' HB3' HD21 ' A' ' 41' ' ' LEU . 4.4 m-20 -47.02 143.3 3.08 Favored 'General case' 0 C--N 1.364 1.214 0 CA-C-O 121.547 0.689 . . . . 0.0 112.049 -179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mt -96.87 124.96 49.95 Favored 'Isoleucine or valine' 0 C--N 1.35 0.611 0 N-CA-C 103.498 -2.778 . . . . 0.0 103.498 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.485 HD22 ' CD1' ' A' ' 48' ' ' ILE . 0.8 OUTLIER -111.07 157.8 19.57 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 125.201 1.563 . . . . 0.0 111.711 -175.685 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -118.99 103.26 9.41 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 128.74 3.775 . . . . 0.0 108.605 176.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 23.5 t -85.19 103.33 12.17 Favored 'Isoleucine or valine' 0 C--N 1.353 0.759 0 C-N-CA 116.139 -2.224 . . . . 0.0 109.744 -176.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 28' ' ' LEU . 0.8 OUTLIER . . . . . 0 C--N 1.355 0.806 0 CA-C-N 112.826 -1.988 . . . . 0.0 105.89 177.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 . . . . . 0 N--CA 1.444 -0.729 0 N-CA-C 112.876 0.695 . . . . 0.0 112.876 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 55.6 m95 -135.85 164.01 28.91 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -178.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -137.47 145.9 43.63 Favored 'General case' 0 C--N 1.358 0.936 0 O-C-N 124.392 1.058 . . . . 0.0 109.198 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.73 115.23 30.08 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 176.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.75 172.12 13.24 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 118.936 -1.106 . . . . 0.0 112.225 -176.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -108.79 130.35 55.39 Favored 'General case' 0 C--N 1.357 0.902 0 CA-C-N 113.566 -1.652 . . . . 0.0 111.789 -178.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.626 ' HB2' HD11 ' A' ' 17' ' ' LEU 0.274 13.6 mt -163.15 146.29 10.57 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-N 110.409 -3.087 . . . . 0.0 115.501 178.131 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.35 29.03 16.19 Favored 'General case' 0 C--N 1.358 0.969 0 CA-C-N 111.374 -2.648 . . . . 0.0 114.929 169.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 71.83 21.15 79.03 Favored Glycine 0 CA--C 1.542 1.757 0 O-C-N 124.433 1.083 . . . . 0.0 114.679 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -138.16 169.59 17.52 Favored 'General case' 0 C--N 1.35 0.606 0 C-N-CA 125.532 1.533 . . . . 0.0 108.45 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -142.27 131.19 22.99 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 112.439 -2.164 . . . . 0.0 105.921 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.582 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -174.91 -179.22 45.35 Favored Glycine 0 C--N 1.344 1.023 0 C-N-CA 118.091 -2.004 . . . . 0.0 112.787 -178.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -78.17 145.04 35.86 Favored 'General case' 0 C--N 1.353 0.734 0 CA-C-N 113.445 -1.378 . . . . 0.0 111.475 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.485 ' CD1' HD22 ' A' ' 25' ' ' LEU . 27.0 pt -144.86 148.13 37.9 Favored Pre-proline 0 C--N 1.351 0.634 0 CA-C-N 112.362 -2.199 . . . . 0.0 108.465 178.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.44 ' HB3' ' HD2' ' B' ' 6' ' ' PRO . 11.6 Cg_endo -78.42 140.74 17.38 Favored 'Trans proline' 0 C--N 1.366 1.498 0 CA-C-N 119.472 0.847 . . . . 0.0 114.289 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.3 ptmm? -70.54 -35.57 73.2 Favored 'General case' 0 C--N 1.362 1.125 0 C-N-CA 116.344 -2.142 . . . . 0.0 113.106 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.268 0.7 OUTLIER -66.76 -9.86 41.2 Favored 'General case' 0 C--N 1.364 1.209 0 C-N-CA 114.276 -2.969 . . . . 0.0 114.57 -179.525 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -92.45 -12.6 31.66 Favored 'General case' 0 C--N 1.359 0.983 0 CA-C-O 117.446 -1.264 . . . . 0.0 111.589 178.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.897 HD11 ' HB1' ' A' ' 3' ' ' ALA . 0.0 OUTLIER -135.52 155.12 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 CA-C-N 119.07 0.85 . . . . 0.0 110.466 178.045 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.511 ' N ' HG12 ' A' ' 53' ' ' ILE . 40.8 tt0 -115.46 146.62 41.48 Favored 'General case' 0 C--N 1.361 1.069 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 177.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.346 0.438 0 CA-C-N 113.157 -1.838 . . . . 0.0 111.91 -178.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . 0.412 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 7.5 Cg_exo . . . . . 0 CA--C 1.551 1.331 0 CA-C-O 122.164 0.818 . . . . 0.0 114.155 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -54.18 158.71 8.92 Favored 'Trans proline' 0 C--N 1.358 1.07 0 N-CA-C 117.1 1.923 . . . . 0.0 117.1 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_endo -70.65 123.3 9.68 Favored 'Trans proline' 0 C--N 1.36 1.163 0 N-CA-C 104.91 -2.765 . . . . 0.0 104.91 173.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.507 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.3 t -63.81 148.39 94.72 Favored Pre-proline 0 C--N 1.35 0.625 0 O-C-N 124.84 1.338 . . . . 0.0 109.205 -178.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' PRO . . . . . 0.507 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 23.2 Cg_exo -62.61 153.48 71.46 Favored 'Trans proline' 0 N--CA 1.447 -1.221 0 O-C-N 122.93 0.963 . . . . 0.0 114.253 178.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -69.62 112.8 3.15 Favored 'Trans proline' 0 C--N 1.363 1.338 0 N-CA-C 106.648 -2.097 . . . . 0.0 106.648 176.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.343 0.303 0 CA-C-N 113.009 -1.905 . . . . 0.0 106.702 -179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.473 ' HB3' ' H ' ' A' ' 25' ' ' LEU . . . . . . . . 0 C--O 1.221 -0.398 0 CA-C-O 123.326 1.536 . . . . 0.0 113.881 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.454 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 2.0 mt -157.42 -177.3 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 100.425 -3.917 . . . . 0.0 100.425 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -165.82 108.87 0.79 Allowed 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 102.389 -3.189 . . . . 0.0 102.389 177.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.9 mtmp? -90.01 -15.19 32.39 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 111.122 -2.763 . . . . 0.0 116.504 -175.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.439 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 32.8 m-85 -142.35 164.79 29.19 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 179.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -71.37 152.88 42.75 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 117.17 -1.812 . . . . 0.0 108.419 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -142.68 142.69 32.08 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.5 tptt -134.83 103.79 5.75 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 112.548 -2.115 . . . . 0.0 108.164 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.25 158.6 0.1 Allowed 'General case' 0 N--CA 1.482 1.15 0 CA-C-O 122.944 1.354 . . . . 0.0 114.199 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.0 p -119.09 -15.28 9.26 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 110.335 -3.121 . . . . 0.0 112.669 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.16 170.08 21.4 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-O 123.316 1.531 . . . . 0.0 113.366 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -50.63 -34.79 27.56 Favored 'General case' 0 CA--C 1.555 1.159 0 CA-C-N 109.948 -3.296 . . . . 0.0 114.337 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -92.19 -5.0 53.38 Favored 'General case' 0 C--N 1.355 0.828 0 N-CA-C 115.551 1.686 . . . . 0.0 115.551 -176.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -108.86 156.5 19.59 Favored 'General case' 0 C--O 1.222 -0.377 0 O-C-N 124.826 1.329 . . . . 0.0 108.936 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.444 HD23 ' C ' ' A' ' 45' ' ' ASP 0.265 2.9 pp -137.79 156.04 48.38 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 112.718 -2.037 . . . . 0.0 111.121 177.831 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 m -84.42 170.54 13.45 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 111.913 -2.403 . . . . 0.0 115.484 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -163.53 175.56 10.58 Favored 'General case' 0 C--N 1.352 0.699 0 CA-C-N 109.461 -3.518 . . . . 0.0 107.586 175.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mtmt -136.53 143.18 43.58 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 112.777 -2.01 . . . . 0.0 106.388 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -44.08 98.05 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.28 0 O-C-N 126.247 2.217 . . . . 0.0 112.957 -178.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 140.34 -23.24 2.71 Favored Glycine 0 CA--C 1.543 1.81 0 CA-C-N 113.428 -1.714 . . . . 0.0 114.992 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -51.22 145.84 7.48 Favored 'General case' 0 C--N 1.363 1.154 0 N-CA-C 116.099 1.888 . . . . 0.0 116.099 -176.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -104.34 112.77 39.24 Favored 'Isoleucine or valine' 0 C--N 1.346 0.456 0 N-CA-C 102.188 -3.264 . . . . 0.0 102.188 173.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.565 HD22 HD13 ' A' ' 48' ' ' ILE . 6.3 mp -104.95 167.76 9.5 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 116.146 -2.222 . . . . 0.0 112.923 -176.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.72 109.15 20.97 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 176.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.402 HG23 ' HB2' ' A' ' 3' ' ' ALA . 71.1 t -87.78 97.02 6.19 Favored 'Isoleucine or valine' 0 C--N 1.357 0.927 0 C-N-CA 114.888 -2.725 . . . . 0.0 107.874 -177.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.446 -0.631 0 CA-C-N 111.955 -2.384 . . . . 0.0 107.484 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.4 m120 . . . . . 0 CA--C 1.566 1.589 0 CA-C-O 119.22 -0.419 . . . . 0.0 109.913 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.5 m95 -136.49 161.31 36.21 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.776 0.798 . . . . 0.0 110.85 -177.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -133.71 150.92 51.52 Favored 'General case' 0 C--N 1.355 0.819 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.7 tttt -102.68 119.16 38.35 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 176.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.0 170.11 16.34 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 118.273 -1.371 . . . . 0.0 113.401 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -110.57 138.55 46.82 Favored 'General case' 0 C--N 1.362 1.116 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.64 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.507 HD11 HD21 ' A' ' 25' ' ' LEU 0.281 12.1 mt -160.02 138.24 10.19 Favored 'General case' 0 CA--C 1.502 -0.88 0 CA-C-N 112.709 -2.041 . . . . 0.0 112.977 179.131 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 56.92 21.9 6.62 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 116.191 -2.203 . . . . 0.0 115.658 168.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 92.51 -9.06 76.58 Favored Glycine 0 CA--C 1.546 1.988 0 N-CA-C 115.37 0.908 . . . . 0.0 115.37 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.9 mttp -113.25 170.05 8.5 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.444 ' C ' HD23 ' A' ' 17' ' ' LEU . 19.9 t70 -140.94 131.17 24.92 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 113.119 -1.855 . . . . 0.0 106.303 -179.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.96 173.37 45.57 Favored Glycine 0 C--N 1.349 1.267 0 C-N-CA 116.401 -2.809 . . . . 0.0 113.217 -177.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -76.77 139.34 40.37 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 123.653 1.692 . . . . 0.0 109.511 -179.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.565 HD13 HD22 ' A' ' 25' ' ' LEU . 1.0 OUTLIER -139.99 143.1 32.93 Favored Pre-proline 0 C--N 1.347 0.498 0 CA-C-N 110.8 -2.909 . . . . 0.0 106.462 179.471 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -74.76 143.75 30.31 Favored 'Trans proline' 0 C--N 1.361 1.216 0 N-CA-C 115.07 1.142 . . . . 0.0 115.07 -175.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 15.6 pttt -71.9 -33.85 68.65 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 116.072 -2.251 . . . . 0.0 113.947 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -62.11 -19.66 63.23 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-N 115.077 -0.965 . . . . 0.0 113.144 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -93.35 -13.34 28.22 Favored 'General case' 0 CA--C 1.566 1.591 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.502 HG21 ' CD1' ' A' ' 48' ' ' ILE . 0.1 OUTLIER -126.86 173.25 12.79 Favored 'Isoleucine or valine' 0 C--N 1.368 1.401 0 CA-C-O 121.808 0.813 . . . . 0.0 111.115 -178.338 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.494 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 0.2 OUTLIER -131.41 137.15 48.55 Favored 'General case' 0 C--N 1.358 0.971 0 CA-C-N 112.691 -2.05 . . . . 0.0 107.494 178.163 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 62.2 mtm . . . . . 0 C--N 1.343 0.301 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.239 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . 0.439 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 5.0 Cg_exo . . . . . 0 CA--C 1.573 2.431 0 N-CA-C 116.069 1.527 . . . . 0.0 116.069 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -52.6 156.35 8.87 Favored 'Trans proline' 0 C--N 1.373 1.831 0 C-N-CA 123.953 3.102 . . . . 0.0 116.785 178.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -74.67 120.34 6.12 Favored 'Trans proline' 0 C--N 1.358 1.037 0 N-CA-C 106.287 -2.236 . . . . 0.0 106.287 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.477 HG12 ' HD2' ' B' ' 6' ' ' PRO . 2.5 t -66.02 149.95 97.14 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-N 113.555 -1.657 . . . . 0.0 109.908 -178.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' PRO . . . . . 0.477 ' HD2' HG12 ' B' ' 5' ' ' VAL . 15.7 Cg_exo -71.26 159.95 50.35 Favored 'Trans proline' 0 C--N 1.359 1.099 0 N-CA-C 116.749 1.788 . . . . 0.0 116.749 178.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -75.94 118.69 5.11 Favored 'Trans proline' 0 C--N 1.359 1.098 0 N-CA-C 107.157 -1.901 . . . . 0.0 107.157 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.497 ' H ' ' NE ' ' B' ' 8' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.345 0.378 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 178.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.638 ' HB1' ' CD1' ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.445 -0.716 0 CA-C-O 122.361 1.077 . . . . 0.0 109.648 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.452 ' H ' HG13 ' A' ' 53' ' ' ILE . 11.1 mt -156.63 110.02 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.806 0 CA-C-N 111.286 -2.688 . . . . 0.0 109.408 -176.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.573 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -68.17 122.13 17.64 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 116.073 -2.251 . . . . 0.0 109.375 178.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -96.16 -23.01 16.94 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -179.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.553 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 17.6 m-85 -140.01 160.57 39.64 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.2 151.22 47.93 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.042 -1.435 . . . . 0.0 109.561 -178.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -143.77 139.3 29.33 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 176.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? -126.45 96.88 4.83 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-N 111.964 -2.38 . . . . 0.0 109.677 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -45.22 149.51 0.5 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 122.192 0.996 . . . . 0.0 113.387 -178.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.8 t -123.92 2.32 8.72 Favored 'General case' 0 C--N 1.354 0.772 0 CA-C-N 111.309 -2.678 . . . . 0.0 114.855 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.4 163.84 39.21 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 118.399 -1.32 . . . . 0.0 110.363 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -50.6 -39.17 49.23 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-N 111.609 -2.541 . . . . 0.0 113.264 -178.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.6 p30 -88.9 1.07 55.97 Favored 'General case' 0 C--N 1.354 0.778 0 N-CA-C 116.421 2.008 . . . . 0.0 116.421 -176.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -113.66 153.14 29.42 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 124.633 1.208 . . . . 0.0 109.382 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.627 HD23 ' N ' ' A' ' 46' ' ' GLY . 0.6 OUTLIER -136.39 158.76 43.66 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 113.47 -1.695 . . . . 0.0 110.793 178.476 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.531 ' O ' HD12 ' A' ' 17' ' ' LEU . 15.7 m -84.2 170.83 13.36 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 116.933 2.197 . . . . 0.0 116.933 -177.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -163.83 170.55 16.7 Favored 'General case' 0 C--N 1.355 0.824 0 CA-C-N 109.07 -3.695 . . . . 0.0 109.863 176.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -135.45 118.29 16.2 Favored 'General case' 0 C--N 1.354 0.787 0 CA-C-N 112.57 -2.105 . . . . 0.0 110.57 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -14.51 74.48 0.0 OUTLIER 'General case' 0 CA--C 1.559 1.291 0 N-CA-C 116.837 2.162 . . . . 0.0 116.837 178.149 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.573 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 150.78 -16.74 0.94 Allowed Glycine 0 CA--C 1.537 1.427 0 CA-C-N 111.847 -2.433 . . . . 0.0 116.0 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.587 ' HB3' HD21 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -50.96 151.59 2.5 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -178.531 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.3 pt -98.71 108.68 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.393 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.621 HD22 HD13 ' A' ' 48' ' ' ILE . 3.0 mp -104.75 157.36 17.25 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 116.443 -2.103 . . . . 0.0 110.804 -177.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -105.0 106.54 17.07 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 110.922 -2.854 . . . . 0.0 108.026 177.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 86.6 t -86.7 111.08 21.01 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 C-N-CA 115.216 -2.594 . . . . 0.0 106.099 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.742 ' O ' HD13 ' A' ' 28' ' ' LEU . 3.4 tm? . . . . . 0 C--N 1.352 0.708 0 CA-C-N 112.592 -2.095 . . . . 0.0 113.844 -176.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.406 ' HA ' ' CD ' ' A' ' 50' ' ' LYS . 22.3 m-20 . . . . . 0 CA--C 1.562 1.441 0 CA-C-O 118.565 -0.731 . . . . 0.0 112.565 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -135.39 169.58 17.27 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 122.357 1.075 . . . . 0.0 109.66 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -137.97 139.62 39.8 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 113.235 -1.802 . . . . 0.0 106.715 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -98.76 115.52 28.94 Favored 'General case' 0 C--N 1.354 0.772 0 N-CA-C 100.393 -3.928 . . . . 0.0 100.393 176.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.49 176.23 8.89 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 125.044 1.465 . . . . 0.0 113.417 -173.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -120.02 148.32 43.71 Favored 'General case' 0 C--N 1.362 1.12 0 O-C-N 125.064 1.478 . . . . 0.0 111.118 -179.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.587 HD21 ' HB3' ' A' ' 23' ' ' ASP 0.302 9.4 mt -161.94 138.93 8.33 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-N 110.465 -3.061 . . . . 0.0 111.953 179.342 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.63 29.06 12.92 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 115.688 -2.405 . . . . 0.0 116.43 168.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.94 10.63 85.42 Favored Glycine 0 CA--C 1.546 2.019 0 C-N-CA 118.662 -1.732 . . . . 0.0 115.013 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -135.73 163.01 31.15 Favored 'General case' 0 C--O 1.217 -0.629 0 C-N-CA 124.597 1.159 . . . . 0.0 107.942 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -141.41 139.73 33.51 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.419 -178.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.627 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -170.96 176.09 44.46 Favored Glycine 0 C--N 1.347 1.161 0 C-N-CA 118.477 -1.82 . . . . 0.0 110.591 -177.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -77.3 144.8 37.83 Favored 'General case' 0 C--N 1.354 0.801 0 CA-C-O 122.522 1.153 . . . . 0.0 110.708 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.621 HD13 HD22 ' A' ' 25' ' ' LEU . 1.3 pt -144.42 139.29 15.48 Favored Pre-proline 0 C--N 1.352 0.677 0 CA-C-N 112.392 -2.185 . . . . 0.0 107.819 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -72.02 148.66 51.38 Favored 'Trans proline' 0 C--N 1.363 1.336 0 CA-C-N 120.018 1.042 . . . . 0.0 114.197 -176.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.406 ' CD ' ' HA ' ' A' ' 35' ' ' ASN . 18.6 ptmt -70.22 -41.69 73.29 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 115.136 -2.626 . . . . 0.0 111.395 -178.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.405 HD22 ' HB2' ' B' ' 3' ' ' PRO . 13.1 p-10 -57.46 -18.68 19.65 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.421 ' CE1' HG22 ' B' ' 5' ' ' VAL . 6.9 m-85 -91.63 -7.81 48.98 Favored 'General case' 0 C--N 1.355 0.843 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.191 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.638 ' CD1' ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -129.83 172.8 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.1 0 CA-C-O 122.184 0.992 . . . . 0.0 108.759 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.438 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 21.7 tt0 -129.47 131.74 46.76 Favored 'General case' 0 C--N 1.349 0.568 0 N-CA-C 104.756 -2.312 . . . . 0.0 104.756 176.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.5 mpp? . . . . . 0 CA--C 1.518 -0.268 0 CA-C-N 113.556 -1.656 . . . . 0.0 110.599 178.027 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . 0.553 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 2.7 Cg_endo . . . . . 0 CA--C 1.579 2.73 0 N-CA-C 116.01 1.504 . . . . 0.0 116.01 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' B' ' 2' ' ' PRO . 36.0 Cg_exo -58.7 161.07 15.79 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 123.594 2.863 . . . . 0.0 118.297 179.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -71.45 117.92 5.4 Favored 'Trans proline' 0 C--N 1.37 1.69 0 N-CA-C 105.498 -2.539 . . . . 0.0 105.498 174.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.435 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.1 t -65.56 147.34 98.73 Favored Pre-proline 0 CA--C 1.551 0.997 0 CA-C-N 113.685 -1.598 . . . . 0.0 109.135 -178.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' PRO . . . . . 0.435 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 2.8 Cg_exo -68.1 159.64 52.19 Favored 'Trans proline' 0 C--N 1.363 1.329 0 N-CA-C 116.805 1.81 . . . . 0.0 116.805 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -76.28 119.81 5.42 Favored 'Trans proline' 0 CA--C 1.553 1.443 0 N-CA-C 107.785 -1.659 . . . . 0.0 107.785 175.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.362 1.118 0 C-N-CA 118.495 -1.282 . . . . 0.0 109.879 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.803 ' HB1' HD11 ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.448 -0.563 0 N-CA-C 105.139 -2.171 . . . . 0.0 105.139 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.7 mt -146.67 112.75 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 N-CA-C 104.924 -2.251 . . . . 0.0 104.924 -174.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.21 144.2 55.02 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-N 112.033 -2.349 . . . . 0.0 110.715 -178.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 mtmt -98.95 -28.04 13.61 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 128.21 2.604 . . . . 0.0 113.205 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.507 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 58.8 m-85 -144.63 164.21 31.63 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 117.521 -1.672 . . . . 0.0 108.463 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -64.53 143.57 57.82 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 113.398 -1.728 . . . . 0.0 107.876 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -142.46 142.67 32.35 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 122.857 1.313 . . . . 0.0 107.902 177.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.25 115.55 16.47 Favored 'General case' 0 CA--C 1.56 1.332 0 CA-C-N 111.632 -2.531 . . . . 0.0 109.687 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.35 147.93 2.13 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.372 0.606 . . . . 0.0 112.435 -177.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.7 p -121.96 -5.52 9.03 Favored 'General case' 0 C--N 1.353 0.74 0 CA-C-N 113.449 -1.705 . . . . 0.0 112.602 -178.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.55 165.34 34.55 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-O 123.34 1.543 . . . . 0.0 110.287 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -50.67 -35.99 33.57 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 110.28 -3.145 . . . . 0.0 115.453 -178.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 52.4 p-10 -93.23 0.9 57.22 Favored 'General case' 0 C--N 1.352 0.684 0 O-C-N 124.444 1.09 . . . . 0.0 113.811 -176.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -109.81 160.81 16.03 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 114.152 -1.385 . . . . 0.0 109.71 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.765 HD11 ' HB2' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -135.8 161.09 36.56 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-N 113.754 -1.566 . . . . 0.0 110.109 179.813 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.531 ' O ' HD12 ' A' ' 17' ' ' LEU . 3.0 m -84.87 163.74 18.83 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 113.676 -1.602 . . . . 0.0 115.186 -179.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 50.9 p90 -164.41 160.46 20.7 Favored 'General case' 0 C--N 1.359 0.991 0 CA-C-N 110.85 -2.886 . . . . 0.0 109.788 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.36 119.36 16.42 Favored 'General case' 0 C--N 1.348 0.542 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.671 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -4.04 92.58 0.01 OUTLIER 'General case' 0 C--N 1.363 1.154 0 C-N-CA 127.185 2.194 . . . . 0.0 114.23 -178.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 118.29 8.03 10.68 Favored Glycine 0 C--N 1.353 1.485 0 O-C-N 125.014 1.446 . . . . 0.0 116.252 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.566 ' HB3' HD21 ' A' ' 41' ' ' LEU . 59.5 m-20 -62.28 152.95 32.15 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 117.372 -1.731 . . . . 0.0 112.936 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 83.6 mt -96.16 112.22 27.94 Favored 'Isoleucine or valine' 0 C--N 1.352 0.702 0 N-CA-C 104.895 -2.261 . . . . 0.0 104.895 178.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.809 HD11 HD11 ' A' ' 41' ' ' LEU . 0.3 OUTLIER -103.93 145.79 29.62 Favored 'General case' 0 C--N 1.352 0.706 0 CA-C-N 113.302 -1.772 . . . . 0.0 111.037 -176.027 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.12 113.03 24.15 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-N 111.714 -2.494 . . . . 0.0 108.429 177.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 t -86.35 108.03 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 115.106 -2.638 . . . . 0.0 111.404 -174.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.434 ' HA ' HD12 ' A' ' 28' ' ' LEU . 12.4 tp . . . . . 0 C--N 1.351 0.641 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 -178.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 . . . . . 0 CA--C 1.548 0.882 0 CA-C-O 119.42 -0.324 . . . . 0.0 111.624 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.7 m95 -139.0 154.84 48.3 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-O 121.316 0.579 . . . . 0.0 110.373 -177.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -136.15 137.57 41.09 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 104.728 -2.323 . . . . 0.0 104.728 175.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -98.78 117.48 33.35 Favored 'General case' 0 C--N 1.353 0.723 0 N-CA-C 105.212 -2.144 . . . . 0.0 105.212 176.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.38 174.95 10.0 Favored 'General case' 0 C--N 1.352 0.68 0 O-C-N 124.346 1.029 . . . . 0.0 111.793 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.5 132.15 52.85 Favored 'General case' 0 C--N 1.359 1.018 0 O-C-N 124.482 1.114 . . . . 0.0 110.23 -178.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.809 HD11 HD11 ' A' ' 25' ' ' LEU 0.257 9.8 mt -159.84 145.8 15.77 Favored 'General case' 0 C--N 1.36 1.025 0 CA-C-N 111.482 -2.599 . . . . 0.0 114.736 178.739 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.26 28.27 13.03 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 110.723 -2.944 . . . . 0.0 115.011 170.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.9 11.54 82.53 Favored Glycine 0 CA--C 1.541 1.688 0 C-N-CA 119.612 -1.28 . . . . 0.0 114.509 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -138.51 -177.89 5.05 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-O 122.566 1.174 . . . . 0.0 110.225 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -141.93 133.07 26.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 112.232 -2.258 . . . . 0.0 105.556 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.427 ' CA ' HD23 ' A' ' 17' ' ' LEU . . . -173.05 173.65 45.68 Favored Glycine 0 C--N 1.338 0.688 0 C-N-CA 117.437 -2.316 . . . . 0.0 111.834 -178.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -77.73 146.61 35.83 Favored 'General case' 0 CA--C 1.56 1.356 0 CA-C-N 112.54 -1.83 . . . . 0.0 110.665 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.9 pt -143.79 144.75 28.16 Favored Pre-proline 0 C--N 1.352 0.711 0 CA-C-N 111.414 -2.63 . . . . 0.0 107.475 177.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -80.18 138.61 12.81 Favored 'Trans proline' 0 C--N 1.367 1.534 0 N-CA-C 114.808 1.042 . . . . 0.0 114.808 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.52 -35.06 70.58 Favored 'General case' 0 C--N 1.354 0.768 0 CA-C-O 117.009 -1.472 . . . . 0.0 113.009 -178.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.277 0.5 OUTLIER -63.03 -10.71 15.06 Favored 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 113.046 -3.462 . . . . 0.0 112.834 178.146 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -94.67 -15.08 24.25 Favored 'General case' 0 CA--C 1.555 1.159 0 CA-C-O 117.47 -1.253 . . . . 0.0 108.942 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.803 HD11 ' HB1' ' A' ' 3' ' ' ALA . 0.0 OUTLIER -133.98 160.56 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-O 122.901 1.334 . . . . 0.0 111.111 178.481 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.449 ' H ' HG12 ' A' ' 53' ' ' ILE . 18.3 tt0 -126.9 145.01 50.83 Favored 'General case' 0 C--N 1.346 0.424 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 178.048 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.343 0.324 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.261 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . 0.507 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 3.2 Cg_exo . . . . . 0 CA--C 1.571 2.331 0 N-CA-C 116.494 1.69 . . . . 0.0 116.494 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -50.6 160.18 1.83 Allowed 'Trans proline' 0 C--N 1.372 1.816 0 C-N-CA 124.499 3.466 . . . . 0.0 118.74 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -75.69 112.77 3.59 Favored 'Trans proline' 0 C--N 1.357 1.02 0 N-CA-C 106.621 -2.107 . . . . 0.0 106.621 176.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 3.5 t -58.26 143.61 79.08 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 113.256 -1.793 . . . . 0.0 109.824 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -61.2 150.31 85.16 Favored 'Trans proline' 0 C--N 1.359 1.117 0 O-C-N 122.789 0.889 . . . . 0.0 114.067 179.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_endo -67.68 111.78 2.46 Favored 'Trans proline' 0 C--N 1.364 1.391 0 N-CA-C 107.713 -1.687 . . . . 0.0 107.713 177.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.353 0.761 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 -178.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.692 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . . . . . . 0 N--CA 1.453 -0.276 0 CA-C-O 121.902 0.858 . . . . 0.0 109.132 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.1 mt -145.01 117.42 2.34 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 CA-C-N 112.647 -2.07 . . . . 0.0 109.762 -176.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.43 125.22 26.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 117.296 -1.762 . . . . 0.0 108.311 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.9 -24.95 16.18 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.521 -1.218 . . . . 0.0 114.139 -178.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.588 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 41.6 m-85 -142.49 165.65 26.83 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -68.84 157.97 35.42 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 116.69 -2.004 . . . . 0.0 109.173 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.488 ' HE1' HG21 ' B' ' 5' ' ' VAL . 12.6 t80 -145.96 142.78 29.02 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 118.554 -1.258 . . . . 0.0 108.895 175.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -129.44 100.96 5.75 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 127.333 2.253 . . . . 0.0 108.993 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.93 160.26 0.04 OUTLIER 'General case' 0 C--N 1.352 0.696 0 CA-C-O 123.079 1.419 . . . . 0.0 113.862 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 p -117.12 -25.63 7.08 Favored 'General case' 0 CA--C 1.557 1.247 0 CA-C-N 110.648 -2.978 . . . . 0.0 112.348 -178.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.73 168.15 26.63 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 117.096 -1.842 . . . . 0.0 110.628 -177.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -42.54 -40.58 2.7 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 109.949 -3.296 . . . . 0.0 114.352 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -85.83 0.86 51.87 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -177.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -112.13 155.84 23.26 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 178.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.553 HD12 ' C ' ' A' ' 17' ' ' LEU . 1.4 pp -136.63 155.58 49.71 Favored 'General case' 0 C--N 1.345 0.411 0 CA-C-N 113.371 -1.74 . . . . 0.0 108.422 178.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.0 m -87.15 173.17 9.41 Favored 'General case' 0 CA--C 1.47 -2.125 0 N-CA-C 119.274 3.065 . . . . 0.0 119.274 -177.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -162.88 -175.6 4.48 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 108.532 -3.94 . . . . 0.0 108.625 175.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.73 140.58 34.88 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 112.328 -2.214 . . . . 0.0 105.95 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.81 101.57 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.875 0 O-C-N 124.974 1.421 . . . . 0.0 111.63 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 136.3 -25.04 3.19 Favored Glycine 0 C--N 1.355 1.59 0 CA-C-N 113.96 -1.473 . . . . 0.0 114.232 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -58.38 145.86 36.81 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 117.036 -1.865 . . . . 0.0 112.8 -177.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.2 mm -97.58 113.95 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 103.398 -2.815 . . . . 0.0 103.398 178.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.612 ' CD1' HD11 ' A' ' 41' ' ' LEU . 1.4 mm? -100.96 162.78 12.65 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 116.241 -2.184 . . . . 0.0 109.697 -175.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -103.31 111.07 23.31 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 108.949 -3.751 . . . . 0.0 105.903 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.674 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 90.1 t -87.83 100.34 10.07 Favored 'Isoleucine or valine' 0 C--N 1.342 0.275 0 C-N-CA 116.391 -2.124 . . . . 0.0 111.259 -175.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 tm? . . . . . 0 C--N 1.349 0.579 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 177.484 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.6 m-20 . . . . . 0 CA--C 1.553 1.074 0 CA-C-O 118.275 -0.869 . . . . 0.0 113.004 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -136.39 161.01 37.02 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.997 0.903 . . . . 0.0 109.517 -177.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -131.91 145.1 51.31 Favored 'General case' 0 C--N 1.345 0.381 0 CA-C-N 112.926 -1.943 . . . . 0.0 106.4 178.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 38.8 tttm -101.65 121.27 41.71 Favored 'General case' 0 C--N 1.348 0.523 0 N-CA-C 105.852 -1.906 . . . . 0.0 105.852 177.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -142.29 176.4 9.02 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 118.719 -1.192 . . . . 0.0 113.464 -176.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -120.73 140.18 52.02 Favored 'General case' 0 C--O 1.203 -1.362 0 CA-C-O 123.608 1.67 . . . . 0.0 111.879 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.612 HD11 ' CD1' ' A' ' 25' ' ' LEU 0.29 16.1 mt -162.14 154.66 19.65 Favored 'General case' 0 C--O 1.189 -2.109 0 CA-C-N 110.033 -3.258 . . . . 0.0 114.005 178.055 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 48.69 23.4 0.64 Allowed 'General case' 0 CA--C 1.555 1.163 0 O-C-N 127.163 2.79 . . . . 0.0 116.237 169.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.94 -5.43 85.13 Favored Glycine 0 CA--C 1.559 2.825 0 N-CA-C 116.439 1.336 . . . . 0.0 116.439 -178.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.9 mtmt -118.57 173.43 6.85 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 123.163 1.459 . . . . 0.0 107.811 177.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.548 ' C ' HD23 ' A' ' 17' ' ' LEU . 35.0 p-10 -142.6 133.31 25.37 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 111.7 -2.5 . . . . 0.0 106.8 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.42 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -169.36 178.03 42.69 Favored Glycine 0 C--N 1.346 1.124 0 C-N-CA 117.091 -2.48 . . . . 0.0 111.344 -178.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -77.46 146.96 36.16 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 118.62 -1.232 . . . . 0.0 112.684 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 21.1 pt -142.29 137.74 15.93 Favored Pre-proline 0 C--N 1.359 0.999 0 CA-C-N 112.62 -2.082 . . . . 0.0 107.506 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -70.38 147.89 59.88 Favored 'Trans proline' 0 C--N 1.356 0.955 0 N-CA-C 114.339 0.861 . . . . 0.0 114.339 -176.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -71.11 -43.29 67.94 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 116.597 -2.041 . . . . 0.0 111.371 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.418 HD22 ' HB2' ' B' ' 3' ' ' PRO . 8.0 p-10 -53.91 -23.99 14.63 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 178.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . 0.618 ' CE1' HG22 ' B' ' 5' ' ' VAL . 6.4 m-85 -89.54 -3.23 58.42 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 118.986 -1.086 . . . . 0.0 111.518 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.692 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -129.54 173.61 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.142 0 CA-C-N 119.64 1.109 . . . . 0.0 108.909 178.775 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.413 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 31.3 tt0 -129.81 121.03 25.98 Favored 'General case' 0 C--N 1.347 0.49 0 N-CA-C 103.487 -2.783 . . . . 0.0 103.487 178.148 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.345 0.373 0 CA-C-N 113.143 -1.844 . . . . 0.0 112.143 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . 0.588 ' HB3' ' CD2' ' A' ' 7' ' ' TYR 0.258 3.4 Cg_exo . . . . . 0 N--CA 1.431 -2.195 0 N-CA-C 115.186 1.187 . . . . 0.0 115.186 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.418 ' HB2' HD22 ' A' ' 51' ' ' ASN . 51.5 Cg_exo -45.91 155.52 0.56 Allowed 'Trans proline' 0 C--N 1.368 1.586 0 C-N-CA 123.127 2.551 . . . . 0.0 116.518 -179.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -76.0 105.82 2.15 Favored 'Trans proline' 0 C--N 1.366 1.484 0 N-CA-C 106.256 -2.248 . . . . 0.0 106.256 178.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.618 HG22 ' CE1' ' A' ' 52' ' ' TYR . 4.2 t -50.36 146.13 9.37 Favored Pre-proline 0 CA--C 1.559 1.314 0 CA-C-N 113.492 -1.686 . . . . 0.0 110.639 -178.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.69 155.66 69.4 Favored 'Trans proline' 0 C--N 1.365 1.44 0 C-N-CA 120.937 1.091 . . . . 0.0 113.854 178.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -73.37 110.29 3.03 Favored 'Trans proline' 0 C--N 1.356 0.928 0 N-CA-C 106.164 -2.283 . . . . 0.0 106.164 176.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.505 0 C-N-CA 116.747 -1.981 . . . . 0.0 106.247 -179.448 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.759 ' HB2' HG13 ' A' ' 27' ' ' VAL . . . . . . . . 0 N--CA 1.453 -0.321 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.2 mt -150.19 122.6 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.352 0.706 0 CA-C-N 113.239 -1.8 . . . . 0.0 109.784 -175.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.517 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -67.04 127.57 33.07 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 113.31 -1.768 . . . . 0.0 110.788 178.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.12 -24.14 18.37 Favored 'General case' 0 CA--C 1.558 1.274 0 CA-C-N 113.887 -1.506 . . . . 0.0 112.577 178.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -141.34 166.5 24.6 Favored 'General case' 0 C--N 1.355 0.836 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -68.86 156.21 38.84 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 116.689 -2.004 . . . . 0.0 108.176 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -146.24 138.82 25.39 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 174.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.407 ' O ' ' CD ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -129.39 103.24 6.8 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 106.506 -1.664 . . . . 0.0 106.506 177.266 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.96 157.62 0.15 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 122.954 1.359 . . . . 0.0 112.236 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -148.29 20.82 1.08 Allowed 'General case' 0 CA--C 1.565 1.548 0 CA-C-N 111.073 -2.785 . . . . 0.0 114.19 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.84 140.7 20.11 Favored 'General case' 0 C--N 1.348 0.527 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -43.08 -32.85 0.75 Allowed 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 114.131 -1.395 . . . . 0.0 114.048 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 53.8 p30 -92.54 -4.59 53.26 Favored 'General case' 0 CA--C 1.568 1.663 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 -178.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -107.34 154.74 20.84 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.89 0.852 . . . . 0.0 108.849 -178.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 pp -133.3 158.72 42.24 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 112.481 -2.145 . . . . 0.0 111.161 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.7 m -85.75 171.63 11.45 Favored 'General case' 0 C--N 1.35 0.601 0 N-CA-C 117.191 2.293 . . . . 0.0 117.191 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.4 p90 -164.36 166.53 20.67 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 109.827 -3.352 . . . . 0.0 109.115 174.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -134.96 111.72 10.05 Favored 'General case' 0 CA--C 1.557 1.236 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.367 178.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -3.88 93.23 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 127.516 2.326 . . . . 0.0 113.962 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.517 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 120.38 3.7 11.4 Favored Glycine 0 CA--C 1.547 2.034 0 CA-C-N 113.688 -1.596 . . . . 0.0 116.495 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . 0.523 ' HB3' HD21 ' A' ' 41' ' ' LEU . 59.8 m-20 -59.12 155.45 13.89 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-O 122.58 1.181 . . . . 0.0 113.196 -178.074 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 pt -96.93 103.92 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.319 0 CA-C-N 111.16 -2.745 . . . . 0.0 104.851 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.606 HD21 HD11 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -108.05 158.95 16.95 Favored 'General case' 0 C--N 1.349 0.587 0 CA-C-N 113.804 -1.543 . . . . 0.0 110.812 -176.181 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.73 109.64 14.49 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 112.295 -2.23 . . . . 0.0 107.192 177.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.759 HG13 ' HB2' ' A' ' 3' ' ' ALA . 1.8 m -85.88 114.98 26.49 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 C-N-CA 117.099 -1.84 . . . . 0.0 110.24 -176.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.585 ' O ' HD13 ' A' ' 28' ' ' LEU . 1.3 tm? . . . . . 0 CA--C 1.544 0.716 0 CA-C-N 111.828 -2.442 . . . . 0.0 117.015 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.2 m120 . . . . . 0 CA--C 1.55 0.95 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -139.96 168.47 19.73 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 121.535 0.684 . . . . 0.0 109.406 -176.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -140.87 150.1 42.8 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.396 -1.274 . . . . 0.0 107.841 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -103.99 117.95 35.51 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 105.397 -2.075 . . . . 0.0 105.397 176.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -140.5 176.62 8.63 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 123.982 0.801 . . . . 0.0 112.399 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -112.03 135.75 52.28 Favored 'General case' 0 C--N 1.364 1.21 0 O-C-N 123.89 0.743 . . . . 0.0 109.728 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.606 HD11 HD21 ' A' ' 25' ' ' LEU . 18.5 mt -160.36 143.67 13.64 Favored 'General case' 0 CA--C 1.468 -2.181 0 C-N-CA 126.864 2.066 . . . . 0.0 115.685 -178.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.25 32.31 18.33 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 115.358 -2.537 . . . . 0.0 115.967 168.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.1 -4.92 68.61 Favored Glycine 0 CA--C 1.558 2.774 0 C-N-CA 119.891 -1.147 . . . . 0.0 115.696 -178.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.0 -175.68 3.29 Favored 'General case' 0 C--N 1.352 0.705 0 CA-C-O 122.983 1.373 . . . . 0.0 109.505 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -142.48 134.25 26.9 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 111.61 -2.541 . . . . 0.0 104.789 178.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.45 175.5 45.59 Favored Glycine 0 C--N 1.35 1.317 0 C-N-CA 116.373 -2.822 . . . . 0.0 112.215 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -77.49 143.67 38.31 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 117.927 -1.509 . . . . 0.0 112.014 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.711 HD12 HG21 ' A' ' 53' ' ' ILE . 3.8 pt -142.57 144.59 30.98 Favored Pre-proline 0 C--N 1.356 0.865 0 CA-C-N 112.064 -2.335 . . . . 0.0 107.817 179.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -77.79 155.38 30.79 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 N-CA-C 118.471 2.451 . . . . 0.0 118.471 -177.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.7 mttt -68.61 -56.5 8.03 Favored 'General case' 0 C--N 1.36 1.042 0 CA-C-N 112.651 -2.068 . . . . 0.0 110.261 178.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.321 0.7 OUTLIER -59.19 -8.34 1.55 Allowed 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 115.28 -2.568 . . . . 0.0 115.683 -179.752 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -95.07 -11.54 28.13 Favored 'General case' 0 CA--C 1.567 1.622 0 CA-C-O 117.642 -1.17 . . . . 0.0 113.55 175.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.711 HG21 HD12 ' A' ' 48' ' ' ILE . 0.1 OUTLIER -133.15 166.56 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 CA-C-N 120.368 1.44 . . . . 0.0 110.159 -178.915 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.404 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 8.3 tt0 -127.71 136.02 50.97 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 112.543 -2.117 . . . . 0.0 105.583 175.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.434 ' CE ' HG11 ' A' ' 27' ' ' VAL . 5.5 mtp . . . . . 0 CA--C 1.538 0.493 0 CA-C-N 114.04 -1.436 . . . . 0.0 108.885 179.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo . . . . . 0 N--CA 1.443 -1.47 0 N-CA-C 117.063 1.909 . . . . 0.0 117.063 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -50.58 159.13 2.33 Favored 'Trans proline' 0 C--N 1.369 1.614 0 C-N-CA 122.07 1.847 . . . . 0.0 115.141 177.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -71.07 119.47 6.33 Favored 'Trans proline' 0 C--N 1.363 1.328 0 N-CA-C 104.394 -2.964 . . . . 0.0 104.394 176.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.418 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 5.4 t -62.85 148.85 91.12 Favored Pre-proline 0 CA--C 1.545 0.771 0 O-C-N 124.59 1.181 . . . . 0.0 108.39 -178.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' PRO . . . . . 0.418 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 12.3 Cg_exo -67.43 163.62 33.98 Favored 'Trans proline' 0 N--CA 1.443 -1.465 0 N-CA-C 115.778 1.415 . . . . 0.0 115.778 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -71.62 119.42 6.22 Favored 'Trans proline' 0 C--N 1.364 1.372 0 O-C-N 124.633 1.86 . . . . 0.0 108.589 175.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.353 0.726 0 CA-C-O 123.349 1.547 . . . . 0.0 109.167 178.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.613 ' HA ' HD12 ' A' ' 53' ' ' ILE . . . . . . . . 0 CA--C 1.554 1.104 0 CA-C-O 124.645 2.164 . . . . 0.0 109.764 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.629 HD13 ' HA ' ' A' ' 24' ' ' ILE . 11.4 mm -148.11 123.19 2.25 Favored 'Isoleucine or valine' 0 C--N 1.354 0.793 0 CA-C-N 109.04 -3.709 . . . . 0.0 106.391 -178.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.71 125.87 27.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.919 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -96.55 -22.89 16.8 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 113.119 -1.855 . . . . 0.0 114.215 -179.023 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -142.22 168.87 18.72 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 124.807 1.317 . . . . 0.0 107.75 -179.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -68.0 146.63 53.37 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 118.17 -1.412 . . . . 0.0 107.832 177.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -145.69 128.78 16.59 Favored 'General case' 0 C--N 1.355 0.841 0 C-N-CA 117.385 -1.726 . . . . 0.0 108.967 176.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.21 102.09 9.28 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-N 111.007 -2.815 . . . . 0.0 109.045 -178.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.05 170.02 0.01 OUTLIER 'General case' 0 C--N 1.382 1.996 0 CA-C-O 124.418 2.056 . . . . 0.0 113.28 -179.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.306 44.2 p -123.92 -25.15 4.29 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 109.886 -3.324 . . . . 0.0 111.175 -177.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.05 172.75 16.39 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 117.81 -1.556 . . . . 0.0 112.259 -174.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -59.84 -25.47 65.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 110.99 -2.823 . . . . 0.0 113.931 -177.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -87.32 -7.66 57.55 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 118.952 -1.099 . . . . 0.0 111.082 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -111.24 162.82 14.58 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 114.043 -1.435 . . . . 0.0 107.495 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.626 HD23 ' N ' ' A' ' 46' ' ' GLY . 0.4 OUTLIER -138.08 156.84 47.37 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 113.827 -1.533 . . . . 0.0 109.029 178.316 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' SER . . . . . 0.569 ' O ' HD12 ' A' ' 17' ' ' LEU . 3.1 m -86.59 162.9 17.75 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 123.425 1.583 . . . . 0.0 115.191 -178.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -162.74 167.77 22.51 Favored 'General case' 0 C--N 1.356 0.854 0 CA-C-N 109.307 -3.588 . . . . 0.0 107.871 175.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.52 147.11 52.17 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 111.005 -2.816 . . . . 0.0 104.71 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -43.04 99.49 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.707 0 O-C-N 125.835 1.96 . . . . 0.0 113.089 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.89 -34.41 1.86 Allowed Glycine 0 C--N 1.351 1.389 0 CA-C-N 113.623 -1.626 . . . . 0.0 115.527 177.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -45.85 151.82 0.42 Allowed 'General case' 0 C--N 1.359 1.016 0 N-CA-C 115.687 1.736 . . . . 0.0 115.687 -177.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.629 ' HA ' HD13 ' A' ' 4' ' ' ILE . 6.9 mt -100.62 121.66 51.67 Favored 'Isoleucine or valine' 0 C--N 1.35 0.622 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 176.2 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.709 HD11 HD11 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -106.86 140.96 38.86 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 -179.003 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.02 110.91 23.0 Favored 'General case' 0 C--O 1.209 -1.069 2 CA-C-N 107.181 -4.554 . . . . 0.0 107.622 -179.173 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 3.5 m -88.05 115.58 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 C-N-CA 118.703 -1.199 . . . . 0.0 110.7 -176.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.555 1.158 0 CA-C-N 113.017 -1.901 . . . . 0.0 110.831 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 . . . . . 0 CA--C 1.56 1.354 0 CA-C-O 119.89 -0.1 . . . . 0.0 110.763 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 69.4 m95 -129.65 174.3 9.82 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-O 121.8 0.809 . . . . 0.0 110.25 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -142.83 138.14 30.12 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 126.058 1.743 . . . . 0.0 107.145 174.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.6 tttm -100.2 114.87 28.61 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 175.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -136.08 172.69 12.65 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 118.671 -1.212 . . . . 0.0 111.578 -175.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -112.6 145.46 40.33 Favored 'General case' 0 C--N 1.367 1.355 0 O-C-N 125.481 1.738 . . . . 0.0 110.53 -177.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.709 HD11 HD11 ' A' ' 25' ' ' LEU 0.295 4.4 mt -159.22 135.6 9.14 Favored 'General case' 0 C--N 1.361 1.104 0 CA-C-N 109.086 -3.688 . . . . 0.0 112.794 178.815 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.87 28.43 10.43 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 112.431 -2.168 . . . . 0.0 114.971 170.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 72.37 29.14 66.59 Favored Glycine 0 CA--C 1.55 2.244 0 C-N-CA 119.775 -1.202 . . . . 0.0 114.067 -179.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -139.31 157.82 45.23 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 126.782 2.033 . . . . 0.0 107.711 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -139.73 142.28 36.83 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . 0.626 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -176.95 173.62 46.44 Favored Glycine 0 CA--C 1.53 1.024 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.874 -179.179 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -77.18 145.36 37.71 Favored 'General case' 0 CA--C 1.573 1.827 0 CA-C-O 122.834 1.302 . . . . 0.0 111.542 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.598 ' CD1' HD23 ' A' ' 25' ' ' LEU . 47.2 pt -143.73 143.89 25.11 Favored Pre-proline 0 C--N 1.355 0.827 0 CA-C-N 113.6 -1.636 . . . . 0.0 107.685 178.025 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.4 ' HG3' HG13 ' B' ' 5' ' ' VAL . 11.3 Cg_endo -73.06 144.91 38.66 Favored 'Trans proline' 0 C--N 1.346 0.447 0 N-CA-C 114.318 0.853 . . . . 0.0 114.318 -177.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.04 -40.79 71.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 115.071 -2.652 . . . . 0.0 111.985 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.453 HD22 ' HB2' ' B' ' 3' ' ' PRO . 10.5 p-10 -55.43 -19.39 9.15 Favored 'General case' 0 CA--C 1.562 1.411 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 177.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -93.25 -4.39 51.96 Favored 'General case' 0 C--N 1.366 1.309 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.613 HD12 ' HA ' ' A' ' 3' ' ' ALA . 0.4 OUTLIER -129.25 176.92 7.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.665 0 CA-C-O 122.991 1.377 . . . . 0.0 111.216 -179.412 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -132.32 138.53 47.83 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 110.807 -2.906 . . . . 0.0 104.942 177.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.35 0.611 0 O-C-N 124.25 0.969 . . . . 0.0 111.691 176.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 N--CA 1.44 -1.645 0 N-CA-C 114.378 0.876 . . . . 0.0 114.378 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.453 ' HB2' HD22 ' A' ' 51' ' ' ASN . 74.2 Cg_exo -51.79 162.09 1.89 Allowed 'Trans proline' 0 C--N 1.367 1.51 0 C-N-CA 122.602 2.201 . . . . 0.0 115.577 177.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -82.96 109.28 1.69 Allowed 'Trans proline' 0 CA--C 1.539 0.75 0 N-CA-C 105.931 -2.373 . . . . 0.0 105.931 175.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.461 HG12 ' HD2' ' B' ' 6' ' ' PRO . 2.5 t -49.1 148.05 4.48 Favored Pre-proline 0 CA--C 1.56 1.353 0 CA-C-N 113.563 -1.653 . . . . 0.0 111.802 -177.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' PRO . . . . . 0.461 ' HD2' HG12 ' B' ' 5' ' ' VAL . 26.8 Cg_exo -67.3 153.98 75.46 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 123.06 2.506 . . . . 0.0 115.689 178.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -65.85 114.35 2.92 Favored 'Trans proline' 0 C--N 1.372 1.794 0 N-CA-C 107.106 -1.921 . . . . 0.0 107.106 175.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.22 -0.482 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 179.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 18.4 ttm . . . . . 0 CA--C 1.539 0.525 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -115.21 153.13 31.42 Favored 'General case' 0 N--CA 1.447 -0.593 0 CA-C-O 123.317 1.532 . . . . 0.0 107.605 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.744 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . . . -137.87 156.04 48.33 Favored 'General case' 0 N--CA 1.444 -0.733 0 CA-C-N 110.248 -3.16 . . . . 0.0 107.46 -178.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.411 ' H ' HG13 ' A' ' 53' ' ' ILE . 47.4 mm -143.7 116.37 3.03 Favored 'Isoleucine or valine' 0 C--N 1.349 0.574 0 CA-C-N 112.484 -2.143 . . . . 0.0 109.623 -175.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.424 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -68.27 125.89 27.84 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 114.003 -1.453 . . . . 0.0 108.185 177.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.1 mmmt -97.35 -26.0 15.03 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.002 -0.999 . . . . 0.0 113.055 -179.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.7 m-85 -142.08 168.28 20.11 Favored 'General case' 0 C--N 1.351 0.645 0 O-C-N 125.031 1.457 . . . . 0.0 107.847 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 -68.98 145.43 53.6 Favored 'General case' 0 C--O 1.216 -0.663 0 CA-C-N 113.591 -1.64 . . . . 0.0 109.129 179.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 22.2 t80 -146.95 128.92 15.45 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 116.946 -1.902 . . . . 0.0 111.166 177.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.2 mmtp -120.49 112.94 19.59 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 112.346 -2.207 . . . . 0.0 108.028 179.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.84 158.88 0.19 Allowed 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 123.408 1.575 . . . . 0.0 113.938 -177.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.1 p -114.28 -22.47 9.91 Favored 'General case' 0 C--N 1.346 0.417 0 CA-C-N 110.719 -2.946 . . . . 0.0 112.258 -177.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -154.03 173.05 16.53 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 113.354 -1.748 . . . . 0.0 111.238 -177.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -54.96 -31.27 60.49 Favored 'General case' 0 CA--C 1.553 1.078 0 CA-C-N 110.278 -3.147 . . . . 0.0 114.478 -178.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 55.0 p-10 -88.88 -2.7 58.72 Favored 'General case' 0 C--N 1.353 0.739 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 -178.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -112.94 156.6 22.73 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 114.011 -1.45 . . . . 0.0 108.552 179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.42 HD23 ' C ' ' A' ' 45' ' ' ASP . 2.8 pp -135.04 152.38 51.64 Favored 'General case' 0 N--CA 1.469 0.519 0 CA-C-N 111.994 -2.366 . . . . 0.0 108.64 177.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . 0.281 57.7 m -82.23 170.88 14.91 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-N 112.013 -2.358 . . . . 0.0 112.462 -177.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 20.4 p90 -163.81 -176.58 4.67 Favored 'General case' 0 C--N 1.343 0.292 0 CA-C-N 108.709 -3.86 . . . . 0.0 106.501 172.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.27 144.54 36.51 Favored 'General case' 0 N--CA 1.442 -0.859 0 N-CA-C 104.494 -2.41 . . . . 0.0 104.494 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.87 102.16 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.247 0 O-C-N 125.068 1.48 . . . . 0.0 112.514 -179.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.424 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 136.25 -24.03 3.27 Favored Glycine 0 C--N 1.355 1.635 0 CA-C-N 115.016 -0.993 . . . . 0.0 114.584 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.402 ' HB3' HD21 ' A' ' 41' ' ' LEU . 4.1 m-20 -50.49 142.48 10.55 Favored 'General case' 0 C--N 1.359 1.01 0 CA-C-O 122.8 1.286 . . . . 0.0 114.2 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 8.7 mm -99.0 116.67 42.65 Favored 'Isoleucine or valine' 0 C--N 1.348 0.533 0 N-CA-C 102.156 -3.276 . . . . 0.0 102.156 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.744 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 3.1 mp -107.2 155.04 20.35 Favored 'General case' 0 C--N 1.349 0.545 0 O-C-N 124.606 1.191 . . . . 0.0 111.547 -176.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.63 110.92 23.01 Favored 'General case' 0 C--N 1.355 0.807 0 CA-C-N 111.343 -2.662 . . . . 0.0 108.854 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.603 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 58.9 t -87.42 106.96 16.67 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.273 0 C-N-CA 116.915 -1.914 . . . . 0.0 110.016 -176.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 15.7 tp -94.26 -99.16 0.15 Allowed 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 112.148 -2.296 . . . . 0.0 107.516 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -74.97 160.27 30.77 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-O 122.706 1.241 . . . . 0.0 110.265 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -168.93 105.32 0.41 Allowed 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 111.766 -2.47 . . . . 0.0 105.495 177.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -84.04 29.01 0.57 Allowed 'General case' 0 C--N 1.358 0.967 0 CA-C-N 113.495 -1.684 . . . . 0.0 113.665 -178.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 96.8 m 58.51 23.57 10.92 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 112.622 -2.081 . . . . 0.0 113.339 -178.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.76 147.13 53.02 Favored 'General case' 0 C--N 1.356 0.874 0 N-CA-C 107.151 -1.426 . . . . 0.0 107.151 177.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 28.2 pt20 -108.34 44.9 1.06 Allowed 'General case' 0 C--O 1.223 -0.309 0 CA-C-N 112.596 -2.093 . . . . 0.0 111.37 -177.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 49.5 m-20 -169.41 -18.14 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.039 0 CA-C-N 111.576 -2.556 . . . . 0.0 113.212 -178.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 78.1 m95 -140.26 166.41 24.75 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-O 121.776 0.798 . . . . 0.0 112.346 -177.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -142.22 146.17 34.89 Favored 'General case' 0 C--N 1.357 0.923 0 CA-C-N 113.228 -1.806 . . . . 0.0 109.648 175.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 18.9 tttt -101.54 118.99 38.08 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 105.054 -2.202 . . . . 0.0 105.054 175.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.27 172.11 13.13 Favored 'General case' 0 C--N 1.351 0.638 0 C-N-CA 119.101 -1.04 . . . . 0.0 111.841 -177.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -109.77 136.23 49.42 Favored 'General case' 0 C--N 1.36 1.036 0 CA-C-N 114.128 -1.396 . . . . 0.0 111.227 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.402 HD21 ' HB3' ' A' ' 23' ' ' ASP 0.283 11.2 mt -160.13 136.02 8.49 Favored 'General case' 0 CA--C 1.504 -0.805 0 CA-C-N 111.755 -2.475 . . . . 0.0 114.611 179.477 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 57.3 21.49 6.77 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 110.731 -2.94 . . . . 0.0 116.32 170.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 94.74 10.7 57.56 Favored Glycine 0 CA--C 1.538 1.489 0 O-C-N 124.299 0.999 . . . . 0.0 113.557 179.696 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -132.01 169.42 16.36 Favored 'General case' 0 C--N 1.354 0.767 0 CA-C-O 122.137 0.97 . . . . 0.0 108.939 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.42 ' C ' HD23 ' A' ' 17' ' ' LEU . 8.7 p-10 -141.51 129.82 22.34 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 112.37 -2.196 . . . . 0.0 107.51 179.253 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.07 -179.96 43.32 Favored Glycine 0 C--N 1.348 1.244 0 C-N-CA 118.768 -1.682 . . . . 0.0 111.842 -178.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -77.52 146.34 36.42 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 113.121 -1.539 . . . . 0.0 110.825 -179.515 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.741 HD13 HD22 ' A' ' 25' ' ' LEU . 2.6 pt -142.83 144.26 28.86 Favored Pre-proline 0 CA--C 1.542 0.666 0 CA-C-N 111.125 -2.761 . . . . 0.0 106.843 179.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_endo -79.2 145.79 19.45 Favored 'Trans proline' 0 C--N 1.364 1.377 0 N-CA-C 115.417 1.276 . . . . 0.0 115.417 -178.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -67.37 -44.24 79.43 Favored 'General case' 0 C--N 1.358 0.958 0 CA-C-N 113.996 -1.456 . . . . 0.0 111.568 -177.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.292 0.7 OUTLIER -67.36 -10.21 48.88 Favored 'General case' 0 CA--C 1.553 1.071 0 C-N-CA 116.794 -1.962 . . . . 0.0 114.255 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 8.5 m-85 -93.62 -10.2 35.44 Favored 'General case' 0 C--N 1.359 1.003 0 CA-C-O 118.417 -0.802 . . . . 0.0 111.474 176.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.677 ' CD1' ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -131.07 175.12 11.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 CA-C-O 122.93 1.347 . . . . 0.0 110.088 179.864 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.516 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 33.3 tt0 -135.67 133.79 38.52 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 111.931 -2.395 . . . . 0.0 106.666 176.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 5.5 mtm -85.87 158.74 19.86 Favored 'General case' 0 C--N 1.348 0.522 0 CA-C-N 114.55 -1.205 . . . . 0.0 109.481 178.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 11.5 mtpp -152.79 95.06 3.07 Favored Pre-proline 0 CA--C 1.561 1.375 0 CA-C-N 113.332 -1.758 . . . . 0.0 110.157 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo . . . . . 0 C--N 1.371 1.738 0 C-N-CA 122.129 1.886 . . . . 0.0 112.971 177.835 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.291 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 97.5 t -77.75 116.55 59.24 Favored Pre-proline 0 CA--C 1.544 0.722 0 N-CA-C 105.082 -2.192 . . . . 0.0 105.082 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -69.78 159.67 52.55 Favored 'Trans proline' 0 C--N 1.364 1.364 0 N-CA-C 115.069 1.142 . . . . 0.0 115.069 178.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_exo -55.84 159.67 11.31 Favored 'Trans proline' 0 C--N 1.365 1.439 0 C-N-CA 122.453 2.102 . . . . 0.0 116.813 177.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 6.8 Cg_endo -72.13 127.29 12.61 Favored 'Trans proline' 0 C--N 1.365 1.4 0 N-CA-C 105.822 -2.415 . . . . 0.0 105.822 173.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.452 HG12 ' HD2' ' B' ' 6' ' ' PRO . 3.0 t -71.33 149.55 94.02 Favored Pre-proline 0 N--CA 1.451 -0.402 0 C-N-CA 118.107 -1.437 . . . . 0.0 109.438 -177.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . 0.452 ' HD2' HG12 ' B' ' 5' ' ' VAL . 15.7 Cg_exo -71.09 155.25 61.77 Favored 'Trans proline' 0 N--CA 1.447 -1.227 0 O-C-N 123.539 1.284 . . . . 0.0 114.797 178.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -70.54 123.42 9.83 Favored 'Trans proline' 0 CA--C 1.548 1.186 0 N-CA-C 106.306 -2.228 . . . . 0.0 106.306 174.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.92 156.65 36.13 Favored 'General case' 0 C--N 1.352 0.705 0 C-N-CA 118.639 -1.224 . . . . 0.0 109.046 -179.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 8.2 mmm-85 72.1 43.34 0.53 Allowed 'General case' 0 CA--C 1.543 0.712 0 CA-C-N 112.841 -1.981 . . . . 0.0 111.954 -179.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.85 107.15 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.339 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.921 179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.29 0 CA-C-N 114.435 -1.257 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 ttt . . . . . 0 N--CA 1.443 -0.822 0 CA-C-O 122.32 1.057 . . . . 0.0 108.419 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 56.1 mt-10 -115.77 151.6 34.87 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 111.254 -2.703 . . . . 0.0 107.393 -179.415 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.703 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . -139.57 156.9 46.61 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 110.781 -2.918 . . . . 0.0 109.392 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 3.1 mt -147.0 116.17 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.646 0 CA-C-N 111.422 -2.626 . . . . 0.0 109.526 -178.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.27 129.51 40.13 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 114.34 -1.3 . . . . 0.0 108.747 177.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 6.0 mmmt -96.46 -23.67 16.47 Favored 'General case' 0 C--O 1.222 -0.391 0 CA-C-N 113.797 -1.547 . . . . 0.0 113.291 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 48.0 m-85 -141.92 168.81 18.88 Favored 'General case' 0 N--CA 1.472 0.633 0 O-C-N 125.203 1.564 . . . . 0.0 108.046 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -68.82 146.89 52.48 Favored 'General case' 0 C--N 1.357 0.892 0 CA-C-N 113.283 -1.781 . . . . 0.0 107.429 179.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -146.87 133.6 20.0 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 117.4 -1.72 . . . . 0.0 108.837 176.152 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm -122.08 112.17 17.91 Favored 'General case' 0 CA--C 1.555 1.147 0 CA-C-N 113.88 -1.509 . . . . 0.0 107.056 177.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.9 154.63 0.7 Allowed 'General case' 0 C--N 1.381 1.943 0 CA-C-O 121.942 0.877 . . . . 0.0 112.639 -179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.9 p -113.26 -17.2 12.38 Favored 'General case' 0 C--N 1.36 1.035 0 CA-C-N 112.372 -2.195 . . . . 0.0 113.964 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.58 163.25 39.47 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-N 114.226 -1.352 . . . . 0.0 109.041 -178.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -52.12 -30.63 27.19 Favored 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 110.709 -2.95 . . . . 0.0 115.008 -177.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 48.1 p-10 -87.97 -1.5 58.03 Favored 'General case' 0 C--N 1.358 0.971 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -177.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -109.1 160.04 16.38 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 113.835 -1.53 . . . . 0.0 108.125 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.601 HD12 ' O ' ' A' ' 18' ' ' SER . 0.4 OUTLIER -135.13 151.88 51.11 Favored 'General case' 0 CA--C 1.551 1.011 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 179.12 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.601 ' O ' HD12 ' A' ' 17' ' ' LEU . 25.9 m -83.04 168.27 17.09 Favored 'General case' 0 CA--C 1.56 1.365 0 CA-C-N 112.851 -1.977 . . . . 0.0 113.753 -178.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -164.08 -174.19 3.47 Favored 'General case' 0 C--N 1.354 0.766 0 CA-C-N 112.591 -2.095 . . . . 0.0 107.818 173.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.86 146.22 40.95 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 112.968 -1.924 . . . . 0.0 105.842 -179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -47.23 102.48 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.254 0 O-C-N 125.575 1.797 . . . . 0.0 111.537 178.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 127.05 -16.38 6.41 Favored Glycine 0 CA--C 1.541 1.678 0 CA-C-N 113.327 -1.76 . . . . 0.0 116.055 178.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 64.6 m-20 -52.42 147.75 7.72 Favored 'General case' 0 C--N 1.365 1.255 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -177.033 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 88.0 mt -99.14 113.43 34.03 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 N-CA-C 103.472 -2.788 . . . . 0.0 103.472 175.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.582 HD22 HD13 ' A' ' 48' ' ' ILE . 4.5 mp -107.71 160.05 16.01 Favored 'General case' 0 C--N 1.35 0.627 0 CA-C-O 122.86 1.314 . . . . 0.0 110.664 -178.325 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.4 ttmt -101.6 112.35 24.89 Favored 'General case' 0 C--O 1.215 -0.742 0 CA-C-N 109.911 -3.313 . . . . 0.0 106.747 178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.536 HG23 ' HB2' ' A' ' 3' ' ' ALA . 25.0 t -87.8 98.1 7.23 Favored 'Isoleucine or valine' 0 C--N 1.349 0.558 0 C-N-CA 113.058 -3.457 . . . . 0.0 108.494 -177.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -96.81 93.54 6.74 Favored 'General case' 0 C--N 1.353 0.721 0 CA-C-N 112.587 -2.097 . . . . 0.0 107.185 177.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.8 t30 90.44 137.92 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 113.487 -1.688 . . . . 0.0 108.984 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -155.37 102.88 2.29 Favored 'General case' 0 C--N 1.35 0.626 0 CA-C-N 111.082 -2.781 . . . . 0.0 106.869 178.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 137.76 121.41 0.0 OUTLIER 'General case' 0 C--N 1.355 0.841 0 C-N-CA 129.176 2.991 . . . . 0.0 107.738 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.8 p 160.76 -41.86 0.0 OUTLIER 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 113.03 -1.896 . . . . 0.0 110.933 179.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -153.06 108.57 3.27 Favored 'General case' 0 C--N 1.349 0.581 0 N-CA-C 105.885 -1.894 . . . . 0.0 105.885 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 -72.89 107.66 5.4 Favored 'General case' 0 C--N 1.353 0.751 0 N-CA-C 105.488 -2.041 . . . . 0.0 105.488 -178.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 141.41 -15.85 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.855 0 C-N-CA 128.34 2.656 . . . . 0.0 112.573 -178.399 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -137.97 153.94 49.4 Favored 'General case' 0 C--N 1.363 1.155 0 O-C-N 123.638 0.586 . . . . 0.0 109.997 -178.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -130.61 151.54 50.96 Favored 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 107.37 -1.344 . . . . 0.0 107.37 176.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -100.72 122.17 42.91 Favored 'General case' 0 C--N 1.355 0.805 0 N-CA-C 104.932 -2.247 . . . . 0.0 104.932 178.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -143.53 168.13 20.59 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 118.736 -1.186 . . . . 0.0 113.61 -177.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.9 tt0 -111.59 135.16 52.55 Favored 'General case' 0 C--N 1.368 1.387 0 O-C-N 125.396 1.685 . . . . 0.0 111.13 179.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.572 ' HB2' HD11 ' A' ' 17' ' ' LEU 0.298 12.4 mt -162.97 143.77 9.55 Favored 'General case' 0 C--N 1.345 0.372 0 CA-C-N 110.695 -2.957 . . . . 0.0 113.93 177.773 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 58.58 29.62 18.71 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 110.479 -3.055 . . . . 0.0 115.501 170.524 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 75.77 18.61 79.57 Favored Glycine 0 CA--C 1.545 1.954 0 CA-C-N 114.434 -1.257 . . . . 0.0 114.088 -179.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -138.93 171.38 14.42 Favored 'General case' 0 C--N 1.356 0.857 0 C-N-CA 124.828 1.251 . . . . 0.0 109.352 179.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -143.05 139.67 30.62 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 112.145 -2.298 . . . . 0.0 108.252 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.575 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -179.24 177.37 48.35 Favored Glycine 0 C--N 1.349 1.264 0 C-N-CA 118.977 -1.582 . . . . 0.0 112.386 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -77.68 145.92 36.34 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-N 113.311 -1.445 . . . . 0.0 110.164 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.582 HD13 HD22 ' A' ' 25' ' ' LEU . 1.6 pt -141.79 144.78 34.1 Favored Pre-proline 0 CA--C 1.54 0.588 0 CA-C-N 111.961 -2.381 . . . . 0.0 107.56 179.783 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_endo -76.7 149.58 30.16 Favored 'Trans proline' 0 C--N 1.369 1.629 0 N-CA-C 116.028 1.511 . . . . 0.0 116.028 -177.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.15 -49.26 62.14 Favored 'General case' 0 C--N 1.353 0.732 0 CA-C-N 112.718 -2.037 . . . . 0.0 111.434 -179.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.253 0.7 OUTLIER -65.54 -7.58 15.33 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 117.08 -1.848 . . . . 0.0 115.92 -179.307 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.406 ' CE1' HG22 ' B' ' 5' ' ' VAL . 8.4 m-85 -93.04 -11.1 33.89 Favored 'General case' 0 C--N 1.358 0.97 0 CA-C-O 118.34 -0.838 . . . . 0.0 112.495 177.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.703 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -128.06 170.32 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 CA-C-O 122.346 1.07 . . . . 0.0 108.82 178.52 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.469 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 17.7 tt0 -128.46 132.96 48.42 Favored 'General case' 0 C--N 1.354 0.775 0 N-CA-C 103.925 -2.62 . . . . 0.0 103.925 177.639 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -84.91 167.98 15.45 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 112.437 -2.165 . . . . 0.0 111.036 -179.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 25.0 mmtt -152.12 86.72 4.41 Favored Pre-proline 0 CA--C 1.547 0.853 0 CA-C-N 110.521 -3.036 . . . . 0.0 105.49 179.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo . . . . . 0 C--N 1.377 2.05 0 C-N-CA 123.349 2.7 . . . . 0.0 116.956 -178.942 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.373 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 13.1 p -44.99 122.41 4.82 Favored Pre-proline 0 CA--C 1.544 0.728 0 O-C-N 124.884 1.365 . . . . 0.0 111.406 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -70.97 159.77 51.46 Favored 'Trans proline' 0 CA--C 1.553 1.471 0 N-CA-C 117.245 1.979 . . . . 0.0 117.245 178.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -59.21 160.31 19.68 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 124.341 3.361 . . . . 0.0 117.01 177.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -76.17 118.9 5.12 Favored 'Trans proline' 0 C--N 1.368 1.563 0 N-CA-C 106.314 -2.226 . . . . 0.0 106.314 174.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.445 HG12 ' HD2' ' B' ' 6' ' ' PRO . 3.1 t -62.73 147.35 93.37 Favored Pre-proline 0 CA--C 1.538 0.515 0 CA-C-N 113.001 -1.909 . . . . 0.0 109.739 -178.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . 0.445 ' HD2' HG12 ' B' ' 5' ' ' VAL . 18.1 Cg_exo -66.66 157.41 61.06 Favored 'Trans proline' 0 C--N 1.359 1.097 0 O-C-N 123.137 1.072 . . . . 0.0 114.468 178.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 11.2 Cg_endo -67.69 120.88 7.9 Favored 'Trans proline' 0 C--N 1.365 1.411 0 N-CA-C 105.904 -2.383 . . . . 0.0 105.904 175.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.27 79.56 8.5 Favored 'General case' 0 C--N 1.357 0.928 0 O-C-N 124.492 1.12 . . . . 0.0 110.778 -178.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 14.4 ptt180 164.36 56.99 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 110.71 -2.95 . . . . 0.0 111.236 178.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 1.3 tpt180 61.35 92.38 0.05 Allowed 'General case' 0 CA--C 1.552 1.035 0 CA-C-O 122.84 1.305 . . . . 0.0 112.414 179.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.157 0 CA-C-N 112.856 -1.975 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.7 ttp . . . . . 0 N--CA 1.447 -0.584 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 72.5 mt-10 -109.5 149.26 29.87 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 112.622 -2.081 . . . . 0.0 105.651 -179.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.703 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . -139.31 153.38 47.73 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 111.761 -2.472 . . . . 0.0 109.362 -177.064 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 15.1 mt -149.03 120.03 1.26 Allowed 'Isoleucine or valine' 0 C--N 1.351 0.635 0 CA-C-N 112.297 -2.229 . . . . 0.0 108.745 -177.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.19 128.38 36.35 Favored 'General case' 0 CA--C 1.544 0.728 0 CA-C-N 113.602 -1.635 . . . . 0.0 111.883 179.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.45 -24.77 15.95 Favored 'General case' 0 C--N 1.347 0.484 0 CA-C-N 114.42 -1.263 . . . . 0.0 113.315 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -139.89 167.61 21.72 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 118.946 -1.102 . . . . 0.0 108.781 -179.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -67.61 145.98 54.31 Favored 'General case' 0 CA--C 1.544 0.742 0 CA-C-N 113.725 -1.579 . . . . 0.0 108.135 179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -146.66 136.5 23.27 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-O 122.6 1.191 . . . . 0.0 109.591 176.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.13 106.57 9.66 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 112.776 -2.011 . . . . 0.0 108.003 178.08 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.11 157.97 0.16 Allowed 'General case' 0 C--N 1.36 1.023 0 CA-C-O 122.631 1.205 . . . . 0.0 113.753 -178.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 8.9 p -112.84 -17.96 12.39 Favored 'General case' 0 CA--C 1.55 0.979 0 CA-C-N 110.942 -2.845 . . . . 0.0 112.054 -177.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.71 169.02 24.34 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 123.071 1.415 . . . . 0.0 111.812 -176.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -50.53 -36.36 33.89 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 110.59 -3.004 . . . . 0.0 112.913 -179.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 39.3 p30 -87.38 -1.4 57.9 Favored 'General case' 0 C--N 1.356 0.851 0 N-CA-C 115.255 1.576 . . . . 0.0 115.255 -177.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -107.69 157.75 17.84 Favored 'General case' 0 N--CA 1.467 0.395 0 O-C-N 124.368 1.042 . . . . 0.0 108.419 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.605 HD23 ' N ' ' A' ' 46' ' ' GLY . 0.3 OUTLIER -132.74 155.12 49.45 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 114.047 -1.433 . . . . 0.0 107.187 178.621 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.59 ' O ' HD12 ' A' ' 17' ' ' LEU . 4.8 m -84.3 171.5 12.65 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-O 123.661 1.696 . . . . 0.0 114.055 -178.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 35.6 p90 -167.43 163.62 14.98 Favored 'General case' 0 C--N 1.347 0.465 0 CA-C-N 111.364 -2.653 . . . . 0.0 107.976 174.319 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.9 pttt -127.39 141.06 51.79 Favored 'General case' 0 C--O 1.223 -0.316 0 N-CA-C 105.45 -2.055 . . . . 0.0 105.45 179.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -40.81 99.63 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.061 0 O-C-N 125.986 2.054 . . . . 0.0 113.843 -176.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 129.55 -7.75 6.21 Favored Glycine 0 C--N 1.36 1.884 0 CA-C-N 113.562 -1.654 . . . . 0.0 116.115 178.312 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.573 ' HB3' HD21 ' A' ' 41' ' ' LEU . 11.2 m-20 -61.61 146.76 47.92 Favored 'General case' 0 C--N 1.356 0.854 0 C-N-CA 117.334 -1.746 . . . . 0.0 112.783 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 26.6 mm -99.08 112.85 32.3 Favored 'Isoleucine or valine' 0 C--N 1.347 0.474 0 N-CA-C 104.516 -2.401 . . . . 0.0 104.516 177.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.692 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 5.1 mp -107.16 160.92 15.21 Favored 'General case' 0 C--N 1.351 0.667 0 C-N-CA 118.301 -1.36 . . . . 0.0 111.693 -175.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.08 113.97 27.89 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-N 110.403 -3.089 . . . . 0.0 107.737 177.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.703 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 57.5 t -85.86 121.29 37.13 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.373 0 C-N-CA 116.486 -2.086 . . . . 0.0 106.885 -177.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 27.2 tp -142.29 84.74 1.88 Allowed 'General case' 0 C--N 1.345 0.39 0 CA-C-N 113.432 -1.713 . . . . 0.0 110.581 -175.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 106.89 148.46 0.01 OUTLIER 'General case' 0 C--N 1.35 0.604 0 CA-C-N 110.783 -2.917 . . . . 0.0 108.297 179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -175.93 74.71 0.02 OUTLIER 'General case' 0 C--N 1.348 0.529 0 CA-C-N 112.547 -2.115 . . . . 0.0 106.975 179.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -166.96 72.59 0.13 Allowed 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 111.572 -2.558 . . . . 0.0 108.471 -177.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.3 t -158.39 -43.61 0.06 Allowed 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 111.207 -2.724 . . . . 0.0 110.747 178.363 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 34.7 m-20 -162.3 120.83 2.22 Favored 'General case' 0 C--N 1.36 1.03 0 O-C-N 124.096 0.873 . . . . 0.0 109.702 179.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -69.82 110.29 4.89 Favored 'General case' 0 C--N 1.351 0.653 0 N-CA-C 105.232 -2.136 . . . . 0.0 105.232 -178.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.6 m120 143.77 -14.43 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.99 0 O-C-N 126.225 2.203 . . . . 0.0 111.554 -179.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 63.8 m95 -136.91 153.28 50.78 Favored 'General case' 0 CA--C 1.554 1.108 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 -178.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.0 m-85 -127.02 147.97 50.13 Favored 'General case' 0 C--N 1.355 0.846 0 N-CA-C 105.592 -2.003 . . . . 0.0 105.592 178.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -102.03 116.28 32.35 Favored 'General case' 0 C--N 1.348 0.519 0 N-CA-C 104.133 -2.544 . . . . 0.0 104.133 176.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.38 173.74 11.29 Favored 'General case' 0 C--N 1.349 0.574 0 C-N-CA 119.086 -1.046 . . . . 0.0 111.154 -177.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -109.26 141.83 41.0 Favored 'General case' 0 C--N 1.359 1.003 0 O-C-N 125.64 1.837 . . . . 0.0 110.675 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.573 HD21 ' HB3' ' A' ' 23' ' ' ASP . 8.3 mt -158.66 119.47 3.33 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 110.575 -3.011 . . . . 0.0 115.76 179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.367 0.0 OUTLIER 61.87 33.17 17.74 Favored 'General case' 0 C--N 1.384 2.092 1 C-N-CA 110.051 -4.66 . . . . 0.0 118.564 173.671 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 60.62 22.39 59.28 Favored Glycine 0 CA--C 1.546 2.022 0 C-N-CA 116.227 -2.892 . . . . 0.0 112.384 -178.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -132.45 137.22 47.18 Favored 'General case' 0 C--N 1.353 0.72 0 N-CA-C 105.673 -1.973 . . . . 0.0 105.673 179.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 18.4 p-10 -130.17 145.77 51.75 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 -178.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.605 ' N ' HD23 ' A' ' 17' ' ' LEU . . . 176.19 178.79 46.25 Favored Glycine 0 C--N 1.34 0.769 0 C-N-CA 116.313 -2.851 . . . . 0.0 112.388 -178.5 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 64.4 m-85 -76.93 143.03 39.82 Favored 'General case' 0 CA--C 1.554 1.131 0 CA-C-O 123.414 1.578 . . . . 0.0 109.331 179.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 1.2 pt -143.37 144.19 27.12 Favored Pre-proline 0 C--O 1.218 -0.556 0 CA-C-N 111.412 -2.631 . . . . 0.0 106.195 178.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -77.09 147.53 26.58 Favored 'Trans proline' 0 C--N 1.356 0.968 0 N-CA-C 116.237 1.591 . . . . 0.0 116.237 -177.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -70.14 -45.76 66.14 Favored 'General case' 0 C--N 1.358 0.938 0 C-N-CA 116.922 -1.911 . . . . 0.0 110.843 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.313 0.5 OUTLIER -62.6 -7.38 4.64 Favored 'General case' 0 CA--C 1.557 1.235 0 C-N-CA 115.137 -2.625 . . . . 0.0 115.617 -177.838 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.704 ' CE1' HG22 ' B' ' 5' ' ' VAL . 6.8 m-85 -93.42 -10.52 34.86 Favored 'General case' 0 CA--C 1.559 1.302 0 CA-C-O 118.738 -0.648 . . . . 0.0 111.611 176.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.703 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -127.3 168.85 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-O 122.314 1.054 . . . . 0.0 108.707 179.602 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.433 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 3.5 tt0 -120.94 136.66 54.91 Favored 'General case' 0 C--N 1.352 0.694 0 N-CA-C 103.11 -2.922 . . . . 0.0 103.11 176.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.89 168.7 14.8 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 113.233 -1.803 . . . . 0.0 110.212 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 6.3 mmmt -151.12 79.27 6.93 Favored Pre-proline 0 CA--C 1.538 0.5 0 CA-C-N 112.009 -2.359 . . . . 0.0 106.348 179.059 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo . . . . . 0 C--N 1.368 1.554 0 O-C-N 124.218 1.641 . . . . 0.0 111.723 179.742 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.258 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 69.1 t -52.28 110.13 1.76 Allowed Pre-proline 0 C--N 1.349 0.585 0 O-C-N 125.508 1.755 . . . . 0.0 111.838 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo -76.63 158.72 35.74 Favored 'Trans proline' 0 N--CA 1.436 -1.91 0 N-CA-C 115.563 1.332 . . . . 0.0 115.563 176.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -58.95 158.41 25.17 Favored 'Trans proline' 0 C--N 1.369 1.643 0 C-N-CA 122.36 2.04 . . . . 0.0 115.89 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -70.14 119.57 6.47 Favored 'Trans proline' 0 C--N 1.362 1.271 0 N-CA-C 106.07 -2.319 . . . . 0.0 106.07 175.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.704 HG22 ' CE1' ' A' ' 52' ' ' TYR . 16.6 t -64.63 149.34 95.76 Favored Pre-proline 0 CA--C 1.543 0.7 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.995 -177.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . 0.403 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 20.2 Cg_exo -66.05 158.66 53.22 Favored 'Trans proline' 0 C--N 1.362 1.256 0 O-C-N 123.052 1.027 . . . . 0.0 114.361 178.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -78.89 118.52 4.12 Favored 'Trans proline' 0 C--N 1.358 1.027 0 N-CA-C 106.549 -2.135 . . . . 0.0 106.549 176.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.17 156.6 28.14 Favored 'General case' 0 C--N 1.352 0.694 0 C-N-CA 117.287 -1.765 . . . . 0.0 109.2 -179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 20.5 mtm105 60.14 42.82 14.94 Favored 'General case' 0 C--N 1.35 0.587 0 CA-C-N 112.401 -2.181 . . . . 0.0 112.93 178.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 16.7 mmm180 30.96 79.56 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.714 0 O-C-N 125.982 2.051 . . . . 0.0 112.663 179.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.21 0 CA-C-N 110.865 -2.88 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 ttp . . . . . 0 N--CA 1.448 -0.572 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -112.39 149.66 32.21 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 112.963 -1.926 . . . . 0.0 106.748 -178.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.629 ' HB2' ' CG2' ' A' ' 27' ' ' VAL . . . -137.41 161.7 35.62 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 111.572 -2.558 . . . . 0.0 108.68 -178.016 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.275 16.4 mm -145.47 118.39 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.772 0 CA-C-N 110.587 -3.006 . . . . 0.0 108.888 -176.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.552 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -68.45 125.54 26.81 Favored 'General case' 0 CA--C 1.552 1.042 0 C-N-CA 117.054 -1.858 . . . . 0.0 107.83 176.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.8 mtmt -95.2 -24.89 16.61 Favored 'General case' 0 N--CA 1.469 0.487 0 N-CA-C 114.176 1.176 . . . . 0.0 114.176 -179.136 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.519 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 52.2 m-85 -141.46 167.41 22.23 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.3 p30 -67.93 147.0 53.07 Favored 'General case' 0 C--N 1.352 0.698 0 CA-C-N 114.049 -1.432 . . . . 0.0 107.494 178.427 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 24.0 t80 -147.37 129.64 15.66 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 116.819 -1.952 . . . . 0.0 110.214 176.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.406 ' H ' ' HD3' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -121.5 116.42 24.66 Favored 'General case' 0 CA--C 1.569 1.687 0 CA-C-N 113.699 -1.591 . . . . 0.0 107.407 177.543 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.58 159.87 0.09 Allowed 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 123.537 1.637 . . . . 0.0 115.185 -176.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 28.4 p -119.14 -15.64 9.19 Favored 'General case' 0 C--N 1.353 0.751 0 CA-C-N 110.162 -3.199 . . . . 0.0 114.057 -179.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.09 160.45 43.43 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-O 123.052 1.406 . . . . 0.0 111.443 -178.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -49.28 -32.2 10.42 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-N 111.066 -2.788 . . . . 0.0 113.462 -179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 44.6 p-10 -89.32 -2.16 58.34 Favored 'General case' 0 CA--C 1.551 0.998 0 N-CA-C 115.988 1.847 . . . . 0.0 115.988 -177.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.7 mt-10 -106.89 162.82 13.48 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 114.051 -1.432 . . . . 0.0 107.761 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.637 HD12 ' O ' ' A' ' 18' ' ' SER . 0.4 OUTLIER -134.58 152.4 51.75 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.058 -1.428 . . . . 0.0 107.824 179.443 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.637 ' O ' HD12 ' A' ' 17' ' ' LEU . 4.2 m -85.0 164.76 18.07 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 124.31 2.005 . . . . 0.0 113.048 -178.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 38.0 p90 -162.16 178.59 8.63 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 111.431 -2.622 . . . . 0.0 108.168 173.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.19 145.98 44.35 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 111.853 -2.431 . . . . 0.0 104.723 -178.28 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -47.48 100.43 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.038 0 O-C-N 125.69 1.869 . . . . 0.0 112.191 -179.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.552 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 130.59 -14.7 5.54 Favored Glycine 0 C--N 1.353 1.482 0 CA-C-O 118.634 -1.092 . . . . 0.0 115.548 179.193 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.684 ' HB3' HD21 ' A' ' 41' ' ' LEU . 37.5 m-20 -53.71 146.09 14.19 Favored 'General case' 0 C--N 1.365 1.269 0 C-N-CA 118.746 -1.182 . . . . 0.0 112.289 -179.46 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 14.3 mm -95.6 116.45 37.28 Favored 'Isoleucine or valine' 0 C--N 1.352 0.688 0 N-CA-C 100.876 -3.75 . . . . 0.0 100.876 177.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.596 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 0.6 OUTLIER -106.61 153.19 22.72 Favored 'General case' 0 C--N 1.348 0.52 0 CA-C-N 113.174 -1.83 . . . . 0.0 111.363 -175.345 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -104.58 109.06 20.81 Favored 'General case' 0 C--O 1.215 -0.739 0 CA-C-N 109.798 -3.364 . . . . 0.0 109.288 -179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.629 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 55.8 t -86.92 110.31 20.18 Favored 'Isoleucine or valine' 0 C--N 1.344 0.356 0 C-N-CA 116.687 -2.005 . . . . 0.0 110.065 -176.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.2 tp -93.62 -108.31 0.12 Allowed 'General case' 0 CA--C 1.551 0.984 0 CA-C-N 112.792 -2.003 . . . . 0.0 109.325 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -74.32 -179.69 4.07 Favored 'General case' 0 C--N 1.359 1.006 0 CA-C-O 121.702 0.763 . . . . 0.0 111.185 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER 172.36 60.11 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 112.559 -2.109 . . . . 0.0 109.931 179.07 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . 0.259 18.0 pt-20 -75.1 -133.27 0.01 OUTLIER 'General case' 0 C--N 1.353 0.749 0 CA-C-N 114.927 -1.033 . . . . 0.0 108.404 178.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 39.2 t -34.56 -47.55 0.33 Allowed 'General case' 0 CA--C 1.551 0.993 0 CA-C-N 112.841 -1.981 . . . . 0.0 113.817 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.4 p30 -51.28 105.93 0.12 Allowed 'General case' 0 C--N 1.357 0.924 0 CA-C-O 123.14 1.447 . . . . 0.0 112.855 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 -87.15 -37.43 17.35 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 112.429 -2.169 . . . . 0.0 112.865 -179.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 67.0 m-20 -92.1 -14.94 28.44 Favored 'General case' 0 N--CA 1.436 -1.135 1 C-N-CA 134.36 5.064 . . . . 0.0 113.519 -176.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 60.8 m95 -135.21 159.27 42.07 Favored 'General case' 0 CA--C 1.553 1.069 0 O-C-N 124.82 1.325 . . . . 0.0 109.218 -179.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.3 m-85 -134.96 148.23 49.96 Favored 'General case' 0 C--N 1.354 0.78 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 176.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.5 ttpp -99.89 117.92 35.22 Favored 'General case' 0 C--N 1.354 0.799 0 N-CA-C 104.442 -2.429 . . . . 0.0 104.442 177.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.48 176.84 8.38 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 113.815 -1.539 . . . . 0.0 111.061 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -126.61 143.79 51.11 Favored 'General case' 0 C--N 1.356 0.871 0 O-C-N 125.33 1.644 . . . . 0.0 110.856 -179.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.684 HD21 ' HB3' ' A' ' 23' ' ' ASP 0.289 10.8 mt -161.9 142.62 10.61 Favored 'General case' 0 CA--C 1.502 -0.882 0 CA-C-N 109.766 -3.379 . . . . 0.0 113.084 178.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.94 30.3 18.93 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 111.544 -2.571 . . . . 0.0 116.352 170.304 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.95 11.61 85.23 Favored Glycine 0 CA--C 1.545 1.95 0 C-N-CA 119.305 -1.426 . . . . 0.0 114.975 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.6 mtmt -136.08 165.24 26.16 Favored 'General case' 0 C--N 1.352 0.689 0 C-N-CA 124.448 1.099 . . . . 0.0 108.055 179.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -139.44 139.06 36.96 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 112.84 -1.982 . . . . 0.0 108.011 -179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.535 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -172.48 178.26 44.67 Favored Glycine 0 C--N 1.344 0.988 0 C-N-CA 118.105 -1.998 . . . . 0.0 111.707 -179.47 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -77.78 146.0 36.09 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 112.628 -1.786 . . . . 0.0 110.369 179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.537 HD13 HD22 ' A' ' 25' ' ' LEU . 35.0 pt -141.88 143.27 27.95 Favored Pre-proline 0 C--N 1.349 0.551 0 CA-C-N 112.128 -2.306 . . . . 0.0 106.023 178.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -75.1 139.42 24.0 Favored 'Trans proline' 0 C--N 1.362 1.273 0 CA-C-N 118.972 0.669 . . . . 0.0 112.664 -178.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.7 pttp -70.05 -21.13 63.2 Favored 'General case' 0 C--N 1.358 0.974 0 C-N-CA 114.761 -2.776 . . . . 0.0 112.978 -179.094 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.62 -18.9 61.55 Favored 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 113.544 -3.262 . . . . 0.0 111.329 -178.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -87.54 -6.87 58.15 Favored 'General case' 0 C--N 1.367 1.358 0 O-C-N 123.851 0.719 . . . . 0.0 112.528 -175.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.605 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -129.76 172.28 15.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.149 0 CA-C-O 121.893 0.854 . . . . 0.0 108.827 177.75 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.459 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 2.4 tt0 -132.87 136.22 46.08 Favored 'General case' 0 CA--C 1.547 0.857 0 CA-C-N 112.848 -1.978 . . . . 0.0 105.938 177.457 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 55.2 mtm -84.39 162.85 19.84 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 112.721 -2.036 . . . . 0.0 110.736 -179.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 1.2 mmtm -151.37 87.66 4.5 Favored Pre-proline 0 CA--C 1.551 0.983 0 CA-C-N 112.333 -2.212 . . . . 0.0 109.801 -178.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo . . . . . 0 C--N 1.367 1.552 0 C-N-CA 122.086 1.857 . . . . 0.0 111.473 177.817 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.272 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 39.1 t -78.03 107.45 5.53 Favored Pre-proline 0 CA--C 1.546 0.789 0 O-C-N 125.193 1.558 . . . . 0.0 107.107 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . 0.519 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 1.9 Cg_endo -66.29 158.5 54.67 Favored 'Trans proline' 0 CA--C 1.564 2.013 0 O-C-N 123.375 1.198 . . . . 0.0 115.007 178.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' B' ' 2' ' ' PRO . 75.2 Cg_exo -57.69 158.12 21.16 Favored 'Trans proline' 0 C--N 1.376 2.009 0 C-N-CA 124.056 3.17 . . . . 0.0 117.627 179.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -71.61 114.05 3.83 Favored 'Trans proline' 0 C--N 1.357 0.989 0 N-CA-C 106.885 -2.006 . . . . 0.0 106.885 175.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.434 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.1 t -54.58 148.27 26.25 Favored Pre-proline 0 C--N 1.354 0.782 0 CA-C-N 113.473 -1.694 . . . . 0.0 109.864 -178.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . 0.434 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 21.0 Cg_exo -64.38 153.83 74.7 Favored 'Trans proline' 0 C--N 1.359 1.129 0 N-CA-C 114.977 1.107 . . . . 0.0 114.977 178.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -76.63 111.05 3.17 Favored 'Trans proline' 0 C--N 1.362 1.242 0 N-CA-C 107.462 -1.784 . . . . 0.0 107.462 176.328 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -90.52 138.72 31.33 Favored 'General case' 0 C--N 1.349 0.544 0 CA-C-N 114.463 -1.244 . . . . 0.0 108.395 -179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 ptt85 177.52 65.33 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 112.284 -2.235 . . . . 0.0 109.634 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -72.11 -80.26 0.06 Allowed 'General case' 0 C--N 1.347 0.492 0 CA-C-N 113.773 -1.558 . . . . 0.0 108.856 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.487 0 CA-C-N 111.044 -2.798 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.3 ttm . . . . . 0 CA--C 1.537 0.48 0 N-CA-C 107.619 -1.252 . . . . 0.0 107.619 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -92.54 152.92 19.37 Favored 'General case' 0 C--N 1.362 1.123 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 179.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.959 ' HB1' HD11 ' A' ' 53' ' ' ILE . . . -141.58 154.62 45.54 Favored 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 110.304 -3.134 . . . . 0.0 105.287 -177.015 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 34.7 mt -154.43 134.35 3.97 Favored 'Isoleucine or valine' 0 C--N 1.348 0.508 0 C-N-CA 117.553 -1.659 . . . . 0.0 109.59 -175.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.526 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -66.92 129.45 39.94 Favored 'General case' 0 CA--C 1.557 1.214 0 CA-C-N 112.504 -2.135 . . . . 0.0 109.596 177.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.3 mmpt? -97.44 -27.19 14.56 Favored 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 113.839 -1.528 . . . . 0.0 111.954 -178.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.422 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 65.0 m-85 -142.44 170.46 15.66 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-N 113.32 -1.763 . . . . 0.0 106.956 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -73.32 142.87 47.1 Favored 'General case' 0 C--O 1.217 -0.616 0 C-N-CA 118.807 -1.157 . . . . 0.0 108.413 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -147.18 127.17 13.63 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 117.418 -1.713 . . . . 0.0 111.225 177.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.94 118.78 33.9 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-N 112.763 -2.017 . . . . 0.0 108.142 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.85 151.53 1.2 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 122.181 0.991 . . . . 0.0 112.216 -177.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.79 -11.0 9.06 Favored 'General case' 0 CA--C 1.554 1.12 0 CA-C-N 112.06 -2.336 . . . . 0.0 112.126 -178.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.43 164.99 37.21 Favored 'General case' 0 C--N 1.356 0.885 0 CA-C-O 123.847 1.784 . . . . 0.0 110.338 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -47.77 -34.67 8.81 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 108.842 -3.799 . . . . 0.0 114.697 -178.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -93.87 0.68 56.31 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 115.257 1.577 . . . . 0.0 115.257 -178.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 26.7 mp0 -112.97 154.55 26.27 Favored 'General case' 0 CA--C 1.546 0.791 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.399 179.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.441 HD23 ' C ' ' A' ' 45' ' ' ASP . 1.9 pp -134.54 154.92 51.22 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 112.807 -1.997 . . . . 0.0 109.854 177.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . 0.255 58.5 m -82.1 166.7 19.48 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-N 111.213 -2.721 . . . . 0.0 113.143 -177.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.9 p90 -163.9 -175.95 4.32 Favored 'General case' 0 C--N 1.351 0.647 0 CA-C-N 110.248 -3.16 . . . . 0.0 107.419 173.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.8 143.82 37.05 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 111.918 -2.401 . . . . 0.0 105.509 179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -46.67 98.57 0.02 OUTLIER 'General case' 0 CA--C 1.562 1.441 0 O-C-N 125.168 1.543 . . . . 0.0 112.866 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.526 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 131.11 -13.28 5.5 Favored Glycine 0 C--N 1.356 1.66 0 O-C-N 124.525 1.14 . . . . 0.0 115.535 179.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.457 ' HB3' HD21 ' A' ' 41' ' ' LEU . 1.8 m-20 -54.52 145.77 17.8 Favored 'General case' 0 C--N 1.363 1.179 0 C-N-CA 119.109 -1.037 . . . . 0.0 112.684 179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.8 mm -97.0 117.0 40.74 Favored 'Isoleucine or valine' 0 C--N 1.352 0.686 0 N-CA-C 103.09 -2.93 . . . . 0.0 103.09 177.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.464 HD21 ' CD1' ' A' ' 41' ' ' LEU . 0.6 OUTLIER -111.04 148.48 32.52 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 112.173 -2.285 . . . . 0.0 112.542 -175.714 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.14 107.54 18.56 Favored 'General case' 0 C--O 1.213 -0.832 0 CA-C-N 110.705 -2.952 . . . . 0.0 108.475 178.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.414 HG13 ' CB ' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -86.34 99.0 7.39 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.943 0 C-N-CA 115.133 -2.627 . . . . 0.0 109.778 -176.814 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 10.1 tp -94.61 102.86 14.79 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 110.509 -3.041 . . . . 0.0 107.292 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 80.71 130.84 0.05 Allowed 'General case' 0 CA--C 1.551 0.997 0 O-C-N 125.265 1.603 . . . . 0.0 109.405 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -165.05 -175.4 3.68 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 111.576 -2.556 . . . . 0.0 106.813 179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 75.25 68.08 0.08 Allowed 'General case' 0 C--N 1.354 0.801 0 CA-C-O 122.864 1.316 . . . . 0.0 109.956 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.7 m -166.86 -74.75 0.03 OUTLIER 'General case' 0 C--N 1.347 0.492 0 CA-C-N 111.284 -2.689 . . . . 0.0 106.748 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -80.7 139.52 36.1 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 113.541 -1.663 . . . . 0.0 107.129 -179.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 81.4 mt-30 -84.77 -23.28 29.28 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 116.191 1.922 . . . . 0.0 116.191 -175.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.537 ' HB2' HH21 ' B' ' 10' ' ' ARG . 19.9 m120 -117.29 -11.33 10.63 Favored 'General case' 0 N--CA 1.436 -1.125 0 C-N-CA 131.082 3.753 . . . . 0.0 115.288 -174.335 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.432 ' CE2' ' HB3' ' B' ' 8' ' ' ARG . 70.5 m95 -132.55 153.98 50.44 Favored 'General case' 0 CA--C 1.55 0.971 0 CA-C-N 119.053 0.842 . . . . 0.0 110.929 -178.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.436 ' O ' ' HA ' ' A' ' 47' ' ' PHE 0.261 21.4 m-85 -133.46 148.51 51.74 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 114.595 -1.184 . . . . 0.0 108.514 177.634 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.2 ttmt -99.19 119.35 37.72 Favored 'General case' 0 N--CA 1.445 -0.703 0 N-CA-C 105.001 -2.222 . . . . 0.0 105.001 179.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.04 172.54 12.54 Favored 'General case' 0 C--N 1.355 0.81 0 C-N-CA 119.181 -1.008 . . . . 0.0 112.162 -176.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -113.7 134.39 54.78 Favored 'General case' 0 C--N 1.362 1.139 0 O-C-N 125.15 1.531 . . . . 0.0 111.915 -178.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.464 ' CD1' HD21 ' A' ' 25' ' ' LEU 0.342 9.4 mt -161.2 137.55 8.35 Favored 'General case' 0 C--N 1.355 0.813 0 CA-C-N 111.662 -2.517 . . . . 0.0 114.565 178.778 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.9 21.14 5.85 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-N 110.218 -3.174 . . . . 0.0 116.661 170.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 91.96 15.22 54.87 Favored Glycine 0 C--N 1.353 1.486 0 CA-C-N 114.359 -1.292 . . . . 0.0 113.287 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 70.2 mttt -134.3 166.74 22.11 Favored 'General case' 0 C--N 1.354 0.773 0 N-CA-C 108.344 -0.984 . . . . 0.0 108.344 179.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.441 ' C ' HD23 ' A' ' 17' ' ' LEU . 5.6 p-10 -141.96 129.64 21.56 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 112.773 -2.012 . . . . 0.0 107.546 179.038 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.49 178.56 44.53 Favored Glycine 0 C--N 1.353 1.493 0 C-N-CA 119.318 -1.42 . . . . 0.0 111.995 -177.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . 0.436 ' HA ' ' O ' ' A' ' 37' ' ' TYR . 69.3 m-85 -77.86 146.28 35.77 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 123.062 1.411 . . . . 0.0 113.481 -178.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 6.2 pt -141.18 144.15 33.54 Favored Pre-proline 0 C--N 1.354 0.788 0 CA-C-N 111.21 -2.723 . . . . 0.0 107.104 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -75.13 150.49 37.7 Favored 'Trans proline' 0 C--N 1.364 1.383 0 N-CA-C 116.327 1.626 . . . . 0.0 116.327 -177.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . 0.342 0.1 OUTLIER -65.97 -45.39 81.87 Favored 'General case' 0 C--N 1.364 1.227 0 CA-C-N 114.043 -1.435 . . . . 0.0 111.446 179.622 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.319 0.7 OUTLIER -68.66 -11.89 60.7 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 116.116 -2.234 . . . . 0.0 114.306 -178.534 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.445 ' CE1' HG22 ' B' ' 5' ' ' VAL . 9.2 m-85 -92.44 -12.56 31.79 Favored 'General case' 0 C--N 1.357 0.924 0 CA-C-O 117.754 -1.117 . . . . 0.0 112.374 177.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.959 HD11 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -133.14 168.67 23.66 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.139 0 CA-C-O 122.303 1.049 . . . . 0.0 109.2 178.925 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.456 ' N ' HG13 ' A' ' 53' ' ' ILE . 2.0 tt0 -136.92 137.63 39.78 Favored 'General case' 0 CA--C 1.55 0.97 0 CA-C-N 113.185 -1.825 . . . . 0.0 107.823 176.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.2 mtm -84.38 168.56 15.46 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 113.707 -1.588 . . . . 0.0 109.072 178.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -151.01 86.33 4.9 Favored Pre-proline 0 CA--C 1.551 0.996 0 CA-C-N 112.343 -2.208 . . . . 0.0 108.387 -178.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo . . . . . 0 C--N 1.374 1.877 0 C-N-CA 122.6 2.2 . . . . 0.0 110.37 178.441 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.282 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 18.9 t -129.09 89.09 49.46 Favored Pre-proline 0 C--N 1.348 0.541 0 N-CA-C 106.229 -1.767 . . . . 0.0 106.229 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . 0.422 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 5.8 Cg_exo -60.31 161.12 20.94 Favored 'Trans proline' 0 C--N 1.365 1.404 0 O-C-N 123.193 1.101 . . . . 0.0 114.337 178.228 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -51.83 160.19 3.08 Favored 'Trans proline' 0 C--N 1.364 1.379 0 C-N-CA 122.652 2.235 . . . . 0.0 116.999 178.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -72.97 126.73 11.5 Favored 'Trans proline' 0 C--N 1.367 1.525 0 N-CA-C 105.762 -2.438 . . . . 0.0 105.762 175.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.445 HG22 ' CE1' ' A' ' 52' ' ' TYR . 10.7 t -70.74 146.71 93.8 Favored Pre-proline 0 CA--C 1.54 0.584 0 C-N-CA 117.688 -1.605 . . . . 0.0 108.92 -177.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . 0.416 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 12.5 Cg_exo -67.9 160.08 50.02 Favored 'Trans proline' 0 N--CA 1.45 -1.084 0 O-C-N 123.358 1.188 . . . . 0.0 114.806 178.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -78.57 116.54 3.83 Favored 'Trans proline' 0 CA--C 1.551 1.329 0 N-CA-C 108.405 -1.421 . . . . 0.0 108.405 176.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.432 ' HB3' ' CE2' ' A' ' 36' ' ' TRP . 0.0 OUTLIER -97.4 104.34 16.35 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 114.304 -1.316 . . . . 0.0 108.865 179.607 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -150.16 50.07 0.9 Allowed 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 112.961 -1.927 . . . . 0.0 110.245 179.334 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . 0.537 HH21 ' HB2' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -178.29 155.06 0.88 Allowed 'General case' 0 C--N 1.358 0.964 0 CA-C-N 113.693 -1.594 . . . . 0.0 110.844 178.327 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.196 0 CA-C-N 113.802 -1.544 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.161 0 N-CA-C 106.382 -1.71 . . . . 0.0 106.382 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.5 tt0 -110.82 147.54 34.3 Favored 'General case' 0 N--CA 1.442 -0.874 0 N-CA-C 104.598 -2.371 . . . . 0.0 104.598 179.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.641 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . -139.91 153.31 46.93 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 111.324 -2.671 . . . . 0.0 107.271 -177.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 45.1 mt -148.98 120.93 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 111.381 -2.645 . . . . 0.0 108.23 -176.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.96 134.08 49.05 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 113.325 -1.761 . . . . 0.0 108.401 176.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 8.4 mtmt -94.22 -22.3 18.5 Favored 'General case' 0 C--O 1.221 -0.398 0 C-N-CA 124.415 1.086 . . . . 0.0 112.563 179.29 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.429 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 88.0 m-85 -142.33 170.29 15.98 Favored 'General case' 0 C--N 1.35 0.611 0 CA-C-N 113.935 -1.484 . . . . 0.0 108.394 -179.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -72.51 149.29 44.24 Favored 'General case' 0 C--O 1.214 -0.8 0 CA-C-N 113.348 -1.751 . . . . 0.0 108.017 179.028 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.443 ' HE1' HG21 ' B' ' 5' ' ' VAL . 26.6 t80 -145.95 134.61 22.23 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 117.693 -1.603 . . . . 0.0 109.409 176.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -122.37 101.25 7.39 Favored 'General case' 0 CA--C 1.561 1.373 0 CA-C-N 111.694 -2.503 . . . . 0.0 109.773 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.55 152.69 0.89 Allowed 'General case' 0 C--N 1.362 1.131 0 CA-C-O 122.123 0.963 . . . . 0.0 113.028 -179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.1 p -118.84 -11.81 9.7 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-N 111.848 -2.433 . . . . 0.0 113.156 -177.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.22 163.58 38.53 Favored 'General case' 0 C--N 1.355 0.809 0 CA-C-O 123.323 1.535 . . . . 0.0 110.201 -178.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -49.08 -31.35 7.75 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 110.332 -3.122 . . . . 0.0 115.343 -178.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 57.4 p30 -90.74 -4.13 56.93 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 115.005 1.483 . . . . 0.0 115.005 -176.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -109.77 158.09 18.48 Favored 'General case' 0 C--O 1.219 -0.515 0 CA-C-N 113.693 -1.594 . . . . 0.0 107.791 -179.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.576 HD12 ' O ' ' A' ' 18' ' ' SER . 0.4 OUTLIER -133.41 152.22 51.89 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 111.624 -2.535 . . . . 0.0 108.134 178.441 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.576 ' O ' HD12 ' A' ' 17' ' ' LEU . 13.3 m -82.94 166.09 19.16 Favored 'General case' 0 C--N 1.354 0.765 0 CA-C-N 112.516 -2.129 . . . . 0.0 112.65 -178.15 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 28.4 p90 -163.7 -175.21 4.02 Favored 'General case' 0 C--N 1.348 0.513 0 CA-C-N 111.145 -2.752 . . . . 0.0 107.646 172.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -139.37 147.31 41.33 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.93 100.72 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.031 0 O-C-N 125.269 1.605 . . . . 0.0 112.651 179.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 129.7 -19.01 5.34 Favored Glycine 0 C--N 1.353 1.476 0 CA-C-O 117.94 -1.478 . . . . 0.0 115.415 178.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.467 ' HB3' HD21 ' A' ' 41' ' ' LEU . 76.8 m-20 -47.73 149.93 1.15 Allowed 'General case' 0 C--N 1.366 1.325 0 N-CA-C 114.501 1.297 . . . . 0.0 114.501 -177.615 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 4.0 mm -97.14 112.65 29.63 Favored 'Isoleucine or valine' 0 C--N 1.35 0.59 0 N-CA-C 103.54 -2.763 . . . . 0.0 103.54 178.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.849 HD11 HD11 ' A' ' 41' ' ' LEU . 3.1 mp -108.79 146.47 33.55 Favored 'General case' 0 C--N 1.35 0.615 0 CA-C-N 114.083 -1.417 . . . . 0.0 111.992 -175.332 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -103.34 112.49 25.4 Favored 'General case' 0 C--O 1.214 -0.788 0 CA-C-N 111.877 -2.419 . . . . 0.0 107.546 179.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.629 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 12.0 t -87.87 99.58 8.98 Favored 'Isoleucine or valine' 0 C--N 1.352 0.679 0 C-N-CA 114.015 -3.074 . . . . 0.0 110.954 -175.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -94.03 93.28 7.76 Favored 'General case' 0 C--N 1.358 0.938 0 CA-C-N 112.976 -1.92 . . . . 0.0 106.009 177.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 80.93 139.39 0.07 Allowed 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 113.154 -1.839 . . . . 0.0 109.073 -178.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -158.53 54.26 0.43 Allowed 'General case' 0 C--N 1.352 0.698 0 CA-C-N 112.545 -2.116 . . . . 0.0 111.386 -178.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . 0.253 0.0 OUTLIER -133.2 -44.06 0.85 Allowed 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 115.766 1.765 . . . . 0.0 115.766 -178.948 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 25.9 p -75.7 33.99 0.12 Allowed 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 109.771 -3.377 . . . . 0.0 114.922 -177.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 178.89 126.75 0.06 Allowed 'General case' 0 CA--C 1.557 1.216 0 N-CA-C 106.705 -1.591 . . . . 0.0 106.705 178.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -84.98 -27.11 26.7 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 -176.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 43.4 m-20 -113.32 -14.18 12.83 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 130.265 3.426 . . . . 0.0 113.884 -176.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 66.5 m95 -134.03 155.82 49.32 Favored 'General case' 0 CA--C 1.548 0.889 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -136.17 153.61 51.21 Favored 'General case' 0 N--CA 1.471 0.596 0 CA-C-N 114.05 -1.432 . . . . 0.0 108.514 177.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 2.9 ttmt -100.69 123.45 44.91 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 106.525 -1.658 . . . . 0.0 106.525 177.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -142.05 173.44 11.52 Favored 'General case' 0 C--N 1.352 0.677 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.683 -178.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 50.8 tt0 -120.92 136.66 54.9 Favored 'General case' 0 C--N 1.367 1.339 0 O-C-N 124.939 1.399 . . . . 0.0 111.062 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.849 HD11 HD11 ' A' ' 25' ' ' LEU 0.264 12.3 mt -160.34 142.38 12.82 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 110.222 -3.172 . . . . 0.0 113.655 178.733 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.03 24.66 9.81 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 109.08 -3.691 . . . . 0.0 115.62 171.297 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.03 14.49 66.89 Favored Glycine 0 C--N 1.357 1.726 0 CA-C-N 114.64 -1.163 . . . . 0.0 113.867 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 6.9 mtpt -134.35 168.13 19.47 Favored 'General case' 0 C--N 1.35 0.605 0 C-N-CA 125.013 1.325 . . . . 0.0 108.662 -179.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -139.49 141.51 37.35 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 112.401 -2.181 . . . . 0.0 107.74 178.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.568 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -177.91 177.95 48.42 Favored Glycine 0 C--N 1.348 1.227 0 C-N-CA 118.268 -1.92 . . . . 0.0 112.755 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -77.94 143.35 37.73 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-N 112.759 -1.72 . . . . 0.0 111.302 179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 28.5 pt -141.89 143.39 28.4 Favored Pre-proline 0 C--N 1.351 0.662 0 CA-C-N 111.597 -2.547 . . . . 0.0 106.611 178.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -78.45 151.29 25.75 Favored 'Trans proline' 0 C--N 1.364 1.352 0 N-CA-C 116.775 1.798 . . . . 0.0 116.775 -177.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -44.12 81.93 Favored 'General case' 0 C--N 1.365 1.275 0 C-N-CA 118.159 -1.416 . . . . 0.0 112.002 179.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.323 0.7 OUTLIER -66.2 -10.77 44.89 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 116.263 -2.175 . . . . 0.0 115.839 -178.787 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.657 ' CE1' HG22 ' B' ' 5' ' ' VAL . 7.8 m-85 -93.96 -10.55 33.33 Favored 'General case' 0 C--N 1.357 0.923 0 CA-C-O 117.356 -1.307 . . . . 0.0 110.911 177.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.641 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -129.95 169.75 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 CA-C-O 123.071 1.415 . . . . 0.0 109.778 179.211 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.5 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 28.2 tt0 -135.35 133.51 38.84 Favored 'General case' 0 CA--C 1.548 0.871 0 CA-C-N 111.179 -2.737 . . . . 0.0 106.198 177.029 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 38.0 mtp -84.99 160.87 19.96 Favored 'General case' 0 C--N 1.353 0.748 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.824 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -151.8 90.48 3.9 Favored Pre-proline 0 CA--C 1.554 1.102 0 CA-C-N 113.653 -1.612 . . . . 0.0 110.662 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo . . . . . 0 C--N 1.367 1.506 0 C-N-CA 122.793 2.329 . . . . 0.0 111.231 177.017 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.29 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 41.9 t -122.18 95.11 47.56 Favored Pre-proline 0 C--N 1.347 0.458 0 O-C-N 125.165 1.541 . . . . 0.0 107.612 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . 0.429 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 5.6 Cg_exo -67.58 165.76 26.29 Favored 'Trans proline' 0 N--CA 1.443 -1.454 0 O-C-N 123.122 1.064 . . . . 0.0 112.297 176.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -49.87 156.13 3.57 Favored 'Trans proline' 0 C--N 1.36 1.135 0 C-N-CA 122.224 1.949 . . . . 0.0 115.846 178.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -70.43 128.06 14.9 Favored 'Trans proline' 0 C--N 1.365 1.435 0 N-CA-C 107.011 -1.957 . . . . 0.0 107.011 176.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.657 HG22 ' CE1' ' A' ' 52' ' ' TYR . 13.3 t -73.59 145.95 85.39 Favored Pre-proline 0 CA--C 1.539 0.556 0 CA-C-N 113.92 -1.491 . . . . 0.0 108.511 -177.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -64.35 158.47 48.82 Favored 'Trans proline' 0 C--N 1.358 1.072 0 O-C-N 123.3 1.158 . . . . 0.0 114.535 179.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -66.55 118.38 5.48 Favored 'Trans proline' 0 C--N 1.36 1.136 0 N-CA-C 108.453 -1.403 . . . . 0.0 108.453 176.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.11 105.02 14.65 Favored 'General case' 0 C--N 1.353 0.733 0 N-CA-C 106.602 -1.629 . . . . 0.0 106.602 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 7.5 ptm180 -164.36 49.56 0.12 Allowed 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 112.37 -2.195 . . . . 0.0 111.517 -178.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.22 133.63 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.855 0 CA-C-N 113.948 -1.478 . . . . 0.0 107.549 179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.35 0.622 0 CA-C-N 114.511 -1.222 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.2 ttt . . . . . 0 N--CA 1.443 -0.79 0 N-CA-C 104.394 -2.447 . . . . 0.0 104.394 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -96.15 149.24 21.85 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 104.301 -2.481 . . . . 0.0 104.301 -179.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.515 ' HB1' ' CD1' ' A' ' 53' ' ' ILE . . . -143.3 157.81 44.16 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 109.936 -3.302 . . . . 0.0 107.395 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.26 20.8 mt -147.19 116.19 1.24 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-N 111.963 -2.38 . . . . 0.0 109.305 -176.202 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.627 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -68.85 123.29 20.57 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 118.333 -1.347 . . . . 0.0 108.301 176.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -95.77 -23.56 16.9 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 -179.289 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 28.5 m-85 -141.16 163.32 33.28 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 125.355 1.659 . . . . 0.0 106.996 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 4.9 p30 -65.08 147.01 54.25 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 113.509 -1.678 . . . . 0.0 109.354 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -144.3 136.89 26.79 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 117.38 -1.728 . . . . 0.0 109.662 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 11.9 mmtm -123.97 102.52 7.81 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 112.748 -2.024 . . . . 0.0 110.192 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.62 152.63 0.92 Allowed 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.381 1.086 . . . . 0.0 112.222 -178.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.9 p -114.65 -14.42 12.05 Favored 'General case' 0 C--N 1.349 0.574 0 CA-C-N 111.464 -2.607 . . . . 0.0 114.306 -177.778 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -150.77 167.52 27.17 Favored 'General case' 0 C--N 1.343 0.301 0 CA-C-O 123.326 1.536 . . . . 0.0 110.049 -177.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 11.4 t70 -54.74 -30.48 56.36 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 110.018 -3.265 . . . . 0.0 113.907 -178.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 59.3 p30 -91.96 -2.8 56.57 Favored 'General case' 0 C--N 1.353 0.741 0 N-CA-C 114.857 1.429 . . . . 0.0 114.857 -177.571 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -108.84 156.01 20.14 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 125.012 1.445 . . . . 0.0 108.411 -179.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.642 HD23 ' N ' ' A' ' 46' ' ' GLY . 0.3 OUTLIER -135.35 152.73 51.73 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 113.66 -1.609 . . . . 0.0 107.146 179.071 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.525 ' O ' HD12 ' A' ' 17' ' ' LEU . 25.0 m -83.0 166.69 18.6 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 112.805 -1.998 . . . . 0.0 113.636 -178.139 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 26.8 p90 -164.04 174.25 11.57 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-N 112.4 -2.182 . . . . 0.0 107.887 174.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 11.5 pttt -139.48 122.44 16.69 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 113.191 -1.822 . . . . 0.0 108.497 179.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -19.43 64.95 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 129.931 3.292 . . . . 0.0 118.29 179.741 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.627 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 158.87 -12.49 0.21 Allowed Glycine 0 CA--C 1.528 0.858 0 CA-C-N 112.452 -2.158 . . . . 0.0 114.622 -179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.417 ' HB3' HD21 ' A' ' 41' ' ' LEU . 41.7 m-20 -50.48 147.56 4.42 Favored 'General case' 0 C--N 1.36 1.041 0 CA-C-O 122.52 1.153 . . . . 0.0 113.414 -179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 70.1 mt -97.35 108.55 21.78 Favored 'Isoleucine or valine' 0 C--N 1.35 0.605 0 N-CA-C 101.618 -3.475 . . . . 0.0 101.618 176.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.507 ' HB2' ' HB3' ' A' ' 3' ' ' ALA . 0.5 OUTLIER -108.22 157.29 18.46 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 111.683 -2.508 . . . . 0.0 111.57 -176.413 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 1.4 mtpp -106.9 103.82 13.34 Favored 'General case' 0 C--O 1.215 -0.717 0 CA-C-N 110.508 -3.042 . . . . 0.0 109.639 176.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.416 HG23 ' HB2' ' A' ' 3' ' ' ALA . 2.3 t -85.52 113.15 23.34 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 C-N-CA 116.71 -1.996 . . . . 0.0 106.663 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.404 HD23 ' H ' ' A' ' 29' ' ' ASN . 1.4 tp -91.72 -119.64 0.08 Allowed 'General case' 0 CA--C 1.553 1.08 0 CA-C-N 112.712 -2.04 . . . . 0.0 107.702 179.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.404 ' H ' HD23 ' A' ' 28' ' ' LEU . 2.1 t-20 -67.39 174.82 3.08 Favored 'General case' 0 C--N 1.355 0.844 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 -178.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 177.67 49.86 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.024 0 CA-C-N 112.596 -2.093 . . . . 0.0 110.642 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -85.39 111.97 20.42 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 112.506 -2.133 . . . . 0.0 109.34 -178.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER 87.31 -48.57 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.713 0 CA-C-N 110.964 -2.834 . . . . 0.0 114.978 175.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 15.0 p30 -57.58 147.29 27.53 Favored 'General case' 0 C--N 1.357 0.928 0 CA-C-O 122.568 1.175 . . . . 0.0 111.325 -178.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.3 mm-40 -141.39 54.95 1.53 Allowed 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 112.69 -2.05 . . . . 0.0 107.804 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 -179.31 -15.01 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.764 0 CA-C-N 111.844 -2.435 . . . . 0.0 113.287 -177.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -136.25 155.76 49.64 Favored 'General case' 0 C--N 1.351 0.673 0 O-C-N 124.15 0.906 . . . . 0.0 108.57 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 25.1 m-85 -136.29 149.7 48.56 Favored 'General case' 0 C--N 1.351 0.663 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 176.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 15.2 ttpt -98.25 120.6 38.93 Favored 'General case' 0 C--N 1.347 0.487 0 N-CA-C 102.101 -3.296 . . . . 0.0 102.101 177.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.99 172.61 12.6 Favored 'General case' 0 C--N 1.348 0.524 0 C-N-CA 118.074 -1.45 . . . . 0.0 112.062 -175.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 51.1 tt0 -125.6 142.04 51.71 Favored 'General case' 0 C--N 1.356 0.861 0 CA-C-N 112.532 -2.122 . . . . 0.0 112.104 -177.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.444 ' HB2' HD11 ' A' ' 17' ' ' LEU . 4.2 mt -158.88 125.17 4.56 Favored 'General case' 0 C--O 1.222 -0.371 1 CA-C-N 108.337 -4.029 . . . . 0.0 115.041 -179.573 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . 0.341 0.0 OUTLIER 61.06 28.98 18.67 Favored 'General case' 0 C--N 1.358 0.943 0 N-CA-C 119.557 3.169 . . . . 0.0 119.557 171.18 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 68.67 22.97 75.53 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 119.694 -1.241 . . . . 0.0 111.909 -179.095 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 20.2 mttt -131.08 142.37 50.27 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 111.126 -2.537 . . . . 0.0 105.37 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -139.67 140.7 36.95 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 113.31 -1.768 . . . . 0.0 107.589 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.642 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -177.19 176.84 48.23 Favored Glycine 0 C--N 1.346 1.089 0 C-N-CA 118.651 -1.738 . . . . 0.0 111.901 -179.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -77.92 141.99 38.69 Favored 'General case' 0 C--N 1.35 0.606 0 CA-C-N 112.732 -1.734 . . . . 0.0 109.057 179.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 22.9 pt -142.12 148.17 47.2 Favored Pre-proline 0 N--CA 1.45 -0.454 0 CA-C-N 110.903 -2.862 . . . . 0.0 106.033 179.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -77.68 138.29 16.93 Favored 'Trans proline' 0 C--N 1.363 1.337 0 N-CA-C 114.066 0.756 . . . . 0.0 114.066 -177.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -33.51 71.89 Favored 'General case' 0 C--N 1.36 1.056 0 C-N-CA 117.315 -1.754 . . . . 0.0 112.549 -177.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.32 0.6 OUTLIER -70.01 -8.45 49.22 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 116.833 -1.947 . . . . 0.0 114.133 179.092 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.419 ' CE1' HG22 ' B' ' 5' ' ' VAL . 6.0 m-85 -93.01 -13.19 29.01 Favored 'General case' 0 CA--C 1.559 1.308 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 176.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.515 ' CD1' ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -128.88 170.62 18.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 CA-C-O 122.572 1.177 . . . . 0.0 109.736 179.606 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.491 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 2.8 tp10 -123.66 145.19 49.14 Favored 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 103.732 -2.692 . . . . 0.0 103.732 176.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . 0.275 38.5 mtm -85.17 -93.83 0.08 Allowed 'General case' 0 C--N 1.342 0.266 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -176.279 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 3.1 mmmm 71.05 94.46 0.05 OUTLIER Pre-proline 0 CA--C 1.563 1.461 0 CA-C-N 111.012 -2.813 . . . . 0.0 110.696 -176.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo . . . . . 0 CA--C 1.559 1.731 0 C-N-CA 121.769 1.646 . . . . 0.0 111.022 177.274 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.286 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . 0.431 ' O ' HG13 ' B' ' 1' ' ' VAL . 7.3 p -91.76 105.74 14.49 Favored Pre-proline 0 CA--C 1.539 0.557 0 O-C-N 126.234 2.209 . . . . 0.0 106.138 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 8.0 Cg_exo -65.95 157.86 57.11 Favored 'Trans proline' 0 CA--C 1.554 1.495 0 N-CA-C 114.204 0.809 . . . . 0.0 114.204 177.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_exo -54.71 160.94 6.63 Favored 'Trans proline' 0 C--N 1.368 1.575 0 C-N-CA 123.358 2.705 . . . . 0.0 116.997 178.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -73.51 127.93 12.23 Favored 'Trans proline' 0 C--N 1.371 1.757 0 N-CA-C 105.561 -2.515 . . . . 0.0 105.561 174.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.487 HG12 ' HD2' ' B' ' 6' ' ' PRO . 2.7 t -73.19 147.22 87.79 Favored Pre-proline 0 N--CA 1.45 -0.468 0 CA-C-N 114.026 -1.443 . . . . 0.0 108.868 -177.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . 0.487 ' HD2' HG12 ' B' ' 5' ' ' VAL . 13.4 Cg_exo -67.49 156.29 66.73 Favored 'Trans proline' 0 N--CA 1.45 -1.073 0 N-CA-C 115.69 1.381 . . . . 0.0 115.69 179.278 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -65.78 123.1 10.88 Favored 'Trans proline' 0 C--N 1.365 1.438 0 N-CA-C 107.347 -1.828 . . . . 0.0 107.347 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.84 84.74 2.04 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 122.989 1.376 . . . . 0.0 110.831 -177.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -174.35 66.47 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.058 0 CA-C-N 112.152 -2.294 . . . . 0.0 109.727 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.273 0.1 OUTLIER -105.55 21.06 17.85 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 113.319 -1.764 . . . . 0.0 112.432 -179.222 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.344 0.345 0 CA-C-N 114.561 -1.2 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.448 -0.554 0 CA-C-O 122.471 1.129 . . . . 0.0 110.15 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.5 tt0 -108.39 142.4 38.8 Favored 'General case' 0 N--CA 1.439 -1.016 0 CA-C-N 111.668 -2.515 . . . . 0.0 104.477 -179.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.608 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . -136.59 160.57 38.4 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 110.746 -2.934 . . . . 0.0 108.323 -176.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.251 44.3 mt -146.99 115.49 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.848 0 CA-C-N 109.931 -3.304 . . . . 0.0 109.423 -176.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.57 125.16 25.65 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 106.408 -1.701 . . . . 0.0 106.408 176.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 10.2 mtmt -95.45 -23.56 17.07 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 114.591 -1.186 . . . . 0.0 113.635 -179.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -140.75 169.06 18.34 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 107.057 -1.46 . . . . 0.0 107.057 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -68.94 150.79 47.32 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.89 179.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -147.64 130.65 16.27 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 116.712 -1.995 . . . . 0.0 109.476 175.419 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -124.07 103.2 8.15 Favored 'General case' 0 CA--C 1.556 1.198 0 N-CA-C 106.088 -1.819 . . . . 0.0 106.088 179.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.82 154.38 0.33 Allowed 'General case' 0 C--N 1.375 1.696 0 O-C-N 124.717 1.261 . . . . 0.0 113.787 -178.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.0 p -111.66 -15.52 13.43 Favored 'General case' 0 C--N 1.358 0.961 0 CA-C-N 111.772 -2.467 . . . . 0.0 112.167 -177.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.42 163.12 40.16 Favored 'General case' 0 C--N 1.351 0.634 0 CA-C-O 123.123 1.439 . . . . 0.0 110.052 -178.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -51.71 -34.24 37.93 Favored 'General case' 0 CA--C 1.548 0.881 0 CA-C-N 110.733 -2.94 . . . . 0.0 115.263 -176.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -89.1 0.1 56.99 Favored 'General case' 0 C--N 1.359 0.99 0 C-N-CA 118.383 -1.327 . . . . 0.0 114.501 -176.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -107.06 159.5 16.25 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 113.013 -1.903 . . . . 0.0 106.236 176.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.562 HD12 ' O ' ' A' ' 18' ' ' SER . 0.4 OUTLIER -136.68 155.41 49.91 Favored 'General case' 0 CA--C 1.562 1.428 0 C-N-CA 118.303 -1.359 . . . . 0.0 108.049 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.562 ' O ' HD12 ' A' ' 17' ' ' LEU . 15.8 m -83.67 163.78 20.08 Favored 'General case' 0 CA--C 1.568 1.645 0 CA-C-N 113.419 -1.719 . . . . 0.0 113.021 -177.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 40.2 p90 -164.71 172.7 12.73 Favored 'General case' 0 C--O 1.22 -0.46 0 CA-C-N 111.074 -2.785 . . . . 0.0 107.457 173.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -132.65 151.64 51.9 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 104.621 -2.363 . . . . 0.0 104.621 178.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.5 ttp180 -46.89 104.48 0.05 Allowed 'General case' 0 CA--C 1.556 1.173 0 CA-C-N 112.994 -1.912 . . . . 0.0 112.381 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.32 -23.22 4.61 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-N 113.446 -1.706 . . . . 0.0 115.743 178.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.405 ' HB3' HD21 ' A' ' 41' ' ' LEU . 47.8 m-20 -48.57 147.65 2.4 Favored 'General case' 0 C--N 1.364 1.239 0 N-CA-C 116.274 1.953 . . . . 0.0 116.274 -177.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.2 mp -100.87 117.05 45.55 Favored 'Isoleucine or valine' 0 C--N 1.346 0.416 0 CA-C-N 111.772 -2.467 . . . . 0.0 104.922 176.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.693 HD22 HD13 ' A' ' 48' ' ' ILE . 4.6 mp -110.67 159.88 17.19 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 122.748 1.261 . . . . 0.0 112.707 -179.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.0 108.14 19.2 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-N 110.78 -2.918 . . . . 0.0 105.633 178.447 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.454 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 2.7 t -87.13 102.3 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.004 0 C-N-CA 111.827 -3.949 . . . . 0.0 110.147 -174.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.9 tt -91.34 97.18 10.94 Favored 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 117.4 -1.72 . . . . 0.0 106.904 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.1 m-80 69.11 154.47 0.12 Allowed 'General case' 0 CA--C 1.55 0.956 0 CA-C-N 112.962 -1.927 . . . . 0.0 110.923 -178.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -166.87 59.58 0.09 Allowed 'General case' 0 CA--C 1.557 1.229 0 CA-C-N 111.436 -2.62 . . . . 0.0 112.927 -177.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -125.97 -28.36 3.19 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 118.107 2.632 . . . . 0.0 118.107 -178.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.9 t -70.41 -8.75 53.22 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 109.972 -3.286 . . . . 0.0 116.184 -175.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -167.1 129.54 1.72 Allowed 'General case' 0 C--N 1.349 0.57 0 CA-C-O 122.759 1.266 . . . . 0.0 109.983 -177.417 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 90.0 mt-30 -72.35 -31.01 65.25 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 112.853 -1.976 . . . . 0.0 115.314 -176.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.458 ' HA ' ' HG2' ' A' ' 50' ' ' LYS . 32.1 m-20 -96.7 -18.52 19.61 Favored 'General case' 0 C--O 1.219 -0.55 0 C-N-CA 131.62 3.968 . . . . 0.0 112.845 -174.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 84.6 m95 -123.38 152.87 41.1 Favored 'General case' 0 CA--C 1.553 1.074 0 O-C-N 124.338 1.024 . . . . 0.0 109.389 179.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -134.21 144.64 48.57 Favored 'General case' 0 CA--C 1.549 0.904 0 N-CA-C 104.992 -2.225 . . . . 0.0 104.992 177.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 3.4 tptt -101.18 124.7 47.29 Favored 'General case' 0 C--N 1.358 0.948 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 178.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -144.34 169.14 18.49 Favored 'General case' 0 C--N 1.357 0.911 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -178.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -109.6 136.16 49.42 Favored 'General case' 0 C--N 1.367 1.342 0 CA-C-N 113.79 -1.55 . . . . 0.0 111.338 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.533 ' HB2' HD11 ' A' ' 17' ' ' LEU 0.304 11.2 mt -162.49 139.76 8.12 Favored 'General case' 0 CA--C 1.51 -0.565 0 CA-C-N 110.297 -3.138 . . . . 0.0 113.577 177.575 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 58.39 28.94 17.52 Favored 'General case' 0 C--N 1.353 0.737 0 CA-C-N 110.829 -2.896 . . . . 0.0 115.48 169.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 77.07 18.19 78.87 Favored Glycine 0 CA--C 1.541 1.698 0 CA-C-N 114.647 -1.16 . . . . 0.0 114.199 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.7 mtpp -137.37 166.56 23.52 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 124.593 1.157 . . . . 0.0 107.937 179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -142.68 136.49 29.09 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 112.33 -2.214 . . . . 0.0 106.423 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.53 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -174.14 175.36 46.6 Favored Glycine 0 C--N 1.347 1.154 0 CA-C-N 114.14 -1.391 . . . . 0.0 112.144 -178.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -78.78 147.83 33.17 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-O 122.927 1.346 . . . . 0.0 110.25 179.115 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.693 HD13 HD22 ' A' ' 25' ' ' LEU . 9.0 pt -142.16 147.85 45.72 Favored Pre-proline 0 CA--C 1.539 0.553 0 CA-C-N 111.54 -2.573 . . . . 0.0 106.162 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -75.41 142.43 26.64 Favored 'Trans proline' 0 C--N 1.362 1.275 0 N-CA-C 114.498 0.922 . . . . 0.0 114.498 -177.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.458 ' HG2' ' HA ' ' A' ' 35' ' ' ASN . 0.0 OUTLIER -70.53 -30.92 67.79 Favored 'General case' 0 C--N 1.369 1.425 0 C-N-CA 113.345 -3.342 . . . . 0.0 113.493 -179.719 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -69.49 -9.54 54.2 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 116.161 -2.216 . . . . 0.0 114.726 -179.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.43 ' CE1' HG22 ' B' ' 5' ' ' VAL . 7.5 m-85 -93.04 -12.0 31.67 Favored 'General case' 0 CA--C 1.551 0.984 0 CA-C-O 118.317 -0.849 . . . . 0.0 111.346 178.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.608 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -128.62 171.66 16.3 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 178.359 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.482 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 85.5 tt0 -132.19 132.96 43.65 Favored 'General case' 0 C--N 1.355 0.817 0 CA-C-N 112.53 -2.123 . . . . 0.0 106.16 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.6 mpp? -85.05 168.89 14.49 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 113.369 -1.741 . . . . 0.0 110.004 179.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 2.8 mtmp? -153.37 83.77 4.47 Favored Pre-proline 0 CA--C 1.547 0.858 0 CA-C-N 112.046 -2.343 . . . . 0.0 109.637 178.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_endo . . . . . 0 C--N 1.37 1.678 0 C-N-CA 121.914 1.743 . . . . 0.0 108.878 176.197 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.334 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 6.0 m -68.82 116.58 42.63 Favored Pre-proline 0 N--CA 1.433 -1.313 0 O-C-N 125.238 1.586 . . . . 0.0 109.442 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . 0.431 ' HA ' ' HD3' ' B' ' 3' ' ' PRO . 2.8 Cg_endo -69.52 154.42 68.7 Favored 'Trans proline' 0 N--CA 1.431 -2.156 0 N-CA-C 115.402 1.27 . . . . 0.0 115.402 178.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' B' ' 2' ' ' PRO . 38.5 Cg_exo -54.81 156.75 14.3 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.663 2.242 . . . . 0.0 117.03 179.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -69.54 123.45 10.18 Favored 'Trans proline' 0 C--N 1.365 1.407 0 N-CA-C 105.345 -2.598 . . . . 0.0 105.345 174.026 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.484 HG12 ' HD2' ' B' ' 6' ' ' PRO . 3.3 t -72.05 150.39 92.47 Favored Pre-proline 0 C--N 1.343 0.296 0 CA-C-N 113.619 -1.628 . . . . 0.0 108.665 -178.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . 0.484 ' HD2' HG12 ' B' ' 5' ' ' VAL . 19.5 Cg_exo -69.99 155.87 64.13 Favored 'Trans proline' 0 N--CA 1.445 -1.328 0 O-C-N 123.473 1.249 . . . . 0.0 112.297 176.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -72.52 118.29 5.52 Favored 'Trans proline' 0 CA--C 1.547 1.16 0 N-CA-C 107.253 -1.864 . . . . 0.0 107.253 175.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.05 162.23 20.42 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 178.692 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 4.5 mtt180 116.76 63.94 0.0 OUTLIER 'General case' 0 C--N 1.355 0.832 0 C-N-CA 130.735 3.614 . . . . 0.0 108.22 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -170.11 142.98 2.38 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.261 -1.336 . . . . 0.0 107.44 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.305 0 CA-C-N 113.978 -1.464 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.222 -0.363 0 N-CA-C 106.387 -1.708 . . . . 0.0 106.387 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.637 ' O ' HG23 ' A' ' 27' ' ' VAL 0.278 1.2 mm-40 -89.89 -81.32 0.29 Allowed 'General case' 0 CA--C 1.555 1.138 0 CA-C-O 123.835 1.779 . . . . 0.0 112.708 -178.469 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.897 ' HB1' HD11 ' A' ' 53' ' ' ILE . . . 80.53 167.23 0.16 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 109.346 -3.57 . . . . 0.0 110.191 -176.631 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . 0.428 12.0 mt -149.61 130.81 4.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.637 0 CA-C-N 111.336 -2.665 . . . . 0.0 111.949 -167.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.467 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -65.84 126.3 28.08 Favored 'General case' 0 CA--C 1.556 1.174 0 CA-C-N 113.589 -1.641 . . . . 0.0 108.742 178.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 mmpt? -98.02 -28.03 13.96 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 114.047 -1.433 . . . . 0.0 114.155 -178.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.412 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 22.1 m-85 -141.38 166.05 25.82 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 106.168 -1.79 . . . . 0.0 106.168 -179.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -66.88 147.8 52.76 Favored 'General case' 0 N--CA 1.476 0.874 0 O-C-N 124.338 1.024 . . . . 0.0 109.451 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.8 t80 -146.69 132.78 19.28 Favored 'General case' 0 C--N 1.354 0.798 0 C-N-CA 118.043 -1.463 . . . . 0.0 109.471 176.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.9 mmtm -122.29 113.07 18.92 Favored 'General case' 0 C--N 1.346 0.431 0 CA-C-N 113.712 -1.585 . . . . 0.0 107.603 178.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.03 149.98 0.84 Allowed 'General case' 0 C--N 1.359 1.01 0 O-C-N 125.639 1.837 . . . . 0.0 112.468 -177.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.4 p -113.68 -19.4 11.59 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 111.054 -2.794 . . . . 0.0 113.557 -177.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.81 167.79 27.87 Favored 'General case' 0 C--N 1.354 0.777 0 CA-C-O 123.776 1.751 . . . . 0.0 111.965 -178.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -43.02 -39.67 2.75 Favored 'General case' 0 CA--C 1.546 0.82 0 CA-C-N 109.824 -3.353 . . . . 0.0 115.393 -179.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 49.2 p-10 -87.74 -0.81 57.41 Favored 'General case' 0 C--N 1.349 0.573 0 N-CA-C 116.268 1.951 . . . . 0.0 116.268 -175.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -106.39 159.77 15.89 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 114.363 -1.29 . . . . 0.0 109.714 -178.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.626 HD11 ' HB2' ' A' ' 41' ' ' LEU . 0.5 OUTLIER -129.06 150.5 50.44 Favored 'General case' 0 CA--C 1.556 1.182 0 CA-C-N 112.017 -2.356 . . . . 0.0 106.213 179.513 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.551 ' O ' HD12 ' A' ' 17' ' ' LEU . 10.2 m -84.07 169.1 15.26 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 123.709 1.718 . . . . 0.0 113.721 -177.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 27.1 p90 -162.69 178.99 8.02 Favored 'General case' 0 C--N 1.358 0.946 0 CA-C-N 111.712 -2.495 . . . . 0.0 108.377 171.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt -139.33 135.18 33.5 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 103.836 -2.653 . . . . 0.0 103.836 -179.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 1.7 tmt_? -42.28 97.95 0.01 OUTLIER 'General case' 0 CA--C 1.545 0.779 0 O-C-N 125.555 1.784 . . . . 0.0 113.489 -177.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.467 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 138.31 -22.81 3.04 Favored Glycine 0 C--N 1.35 1.344 0 CA-C-N 113.209 -1.814 . . . . 0.0 115.33 178.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.619 ' HB3' HD21 ' A' ' 41' ' ' LEU . 4.4 m-20 -47.02 143.3 3.08 Favored 'General case' 0 C--N 1.364 1.214 0 CA-C-O 121.547 0.689 . . . . 0.0 112.049 -179.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 45.8 mt -96.87 124.96 49.95 Favored 'Isoleucine or valine' 0 C--N 1.35 0.611 0 N-CA-C 103.498 -2.778 . . . . 0.0 103.498 178.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.485 HD22 ' CD1' ' A' ' 48' ' ' ILE . 0.8 OUTLIER -111.07 157.8 19.57 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 125.201 1.563 . . . . 0.0 111.711 -175.685 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -118.99 103.26 9.41 Favored 'General case' 0 C--N 1.362 1.137 0 O-C-N 128.74 3.775 . . . . 0.0 108.605 176.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.637 HG23 ' O ' ' A' ' 2' ' ' GLU . 23.5 t -85.19 103.33 12.17 Favored 'Isoleucine or valine' 0 C--N 1.353 0.759 0 C-N-CA 116.139 -2.224 . . . . 0.0 109.744 -176.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 28' ' ' LEU . 0.8 OUTLIER -92.85 96.99 10.47 Favored 'General case' 0 C--N 1.355 0.806 0 CA-C-N 112.826 -1.988 . . . . 0.0 105.89 177.742 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.3 t30 71.72 161.49 0.24 Allowed 'General case' 0 CA--C 1.558 1.27 0 CA-C-N 113.235 -1.802 . . . . 0.0 111.808 -179.056 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -168.46 96.0 0.39 Allowed 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 111.441 -2.618 . . . . 0.0 106.425 -178.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -174.33 58.3 0.02 OUTLIER 'General case' 0 C--N 1.347 0.494 0 CA-C-O 123.768 1.747 . . . . 0.0 108.12 -177.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 1.7 t -121.71 -65.99 1.08 Allowed 'General case' 0 C--O 1.222 -0.344 0 CA-C-N 110.293 -3.14 . . . . 0.0 108.129 179.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -161.0 120.54 2.63 Favored 'General case' 0 C--N 1.347 0.464 0 CA-C-N 113.635 -1.62 . . . . 0.0 106.952 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.4 pm0 -62.88 109.63 1.51 Allowed 'General case' 0 C--N 1.355 0.805 0 N-CA-C 105.514 -2.032 . . . . 0.0 105.514 -178.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 56.8 m-20 147.13 -16.59 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 128.513 2.725 . . . . 0.0 112.876 -174.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 55.6 m95 -135.85 164.01 28.91 Favored 'General case' 0 C--N 1.357 0.918 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -178.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -137.47 145.9 43.63 Favored 'General case' 0 C--N 1.358 0.936 0 O-C-N 124.392 1.058 . . . . 0.0 109.198 179.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.73 115.23 30.08 Favored 'General case' 0 C--N 1.356 0.872 0 N-CA-C 104.46 -2.422 . . . . 0.0 104.46 176.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.75 172.12 13.24 Favored 'General case' 0 C--N 1.355 0.822 0 C-N-CA 118.936 -1.106 . . . . 0.0 112.225 -176.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -108.79 130.35 55.39 Favored 'General case' 0 C--N 1.357 0.902 0 CA-C-N 113.566 -1.652 . . . . 0.0 111.789 -178.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.626 ' HB2' HD11 ' A' ' 17' ' ' LEU 0.274 13.6 mt -163.15 146.29 10.57 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-N 110.409 -3.087 . . . . 0.0 115.501 178.131 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 57.35 29.03 16.19 Favored 'General case' 0 C--N 1.358 0.969 0 CA-C-N 111.374 -2.648 . . . . 0.0 114.929 169.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 71.83 21.15 79.03 Favored Glycine 0 CA--C 1.542 1.757 0 O-C-N 124.433 1.083 . . . . 0.0 114.679 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -138.16 169.59 17.52 Favored 'General case' 0 C--N 1.35 0.606 0 C-N-CA 125.532 1.533 . . . . 0.0 108.45 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 23.1 t0 -142.27 131.19 22.99 Favored 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 112.439 -2.164 . . . . 0.0 105.921 179.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.582 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -174.91 -179.22 45.35 Favored Glycine 0 C--N 1.344 1.023 0 C-N-CA 118.091 -2.004 . . . . 0.0 112.787 -178.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -78.17 145.04 35.86 Favored 'General case' 0 C--N 1.353 0.734 0 CA-C-N 113.445 -1.378 . . . . 0.0 111.475 -179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.485 ' CD1' HD22 ' A' ' 25' ' ' LEU . 27.0 pt -144.86 148.13 37.9 Favored Pre-proline 0 C--N 1.351 0.634 0 CA-C-N 112.362 -2.199 . . . . 0.0 108.465 178.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.44 ' HB3' ' HD2' ' B' ' 6' ' ' PRO . 11.6 Cg_endo -78.42 140.74 17.38 Favored 'Trans proline' 0 C--N 1.366 1.498 0 CA-C-N 119.472 0.847 . . . . 0.0 114.289 -179.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.3 ptmm? -70.54 -35.57 73.2 Favored 'General case' 0 C--N 1.362 1.125 0 C-N-CA 116.344 -2.142 . . . . 0.0 113.106 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.268 0.7 OUTLIER -66.76 -9.86 41.2 Favored 'General case' 0 C--N 1.364 1.209 0 C-N-CA 114.276 -2.969 . . . . 0.0 114.57 -179.525 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -92.45 -12.6 31.66 Favored 'General case' 0 C--N 1.359 0.983 0 CA-C-O 117.446 -1.264 . . . . 0.0 111.589 178.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.897 HD11 ' HB1' ' A' ' 3' ' ' ALA . 0.0 OUTLIER -135.52 155.12 36.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 CA-C-N 119.07 0.85 . . . . 0.0 110.466 178.045 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.511 ' N ' HG12 ' A' ' 53' ' ' ILE . 40.8 tt0 -115.46 146.62 41.48 Favored 'General case' 0 C--N 1.361 1.069 0 N-CA-C 106.609 -1.626 . . . . 0.0 106.609 177.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -85.26 159.52 20.05 Favored 'General case' 0 C--N 1.346 0.438 0 CA-C-N 113.157 -1.838 . . . . 0.0 111.91 -178.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 21.2 mmtt -151.27 83.53 5.48 Favored Pre-proline 0 CA--C 1.542 0.669 0 CA-C-N 112.769 -2.014 . . . . 0.0 108.872 179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo . . . . . 0 C--N 1.369 1.608 0 C-N-CA 122.011 1.807 . . . . 0.0 108.435 176.277 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.224 -0.278 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 96.6 t -97.35 108.62 45.74 Favored Pre-proline 0 C--N 1.349 0.576 0 N-CA-C 105.493 -2.04 . . . . 0.0 105.493 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . 0.412 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 7.5 Cg_exo -62.75 159.71 36.14 Favored 'Trans proline' 0 CA--C 1.551 1.331 0 O-C-N 123.16 1.084 . . . . 0.0 114.155 178.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_exo -54.18 158.71 8.92 Favored 'Trans proline' 0 C--N 1.358 1.07 0 N-CA-C 117.1 1.923 . . . . 0.0 117.1 179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_endo -70.65 123.3 9.68 Favored 'Trans proline' 0 C--N 1.36 1.163 0 N-CA-C 104.91 -2.765 . . . . 0.0 104.91 173.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.507 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.3 t -63.81 148.39 94.72 Favored Pre-proline 0 C--N 1.35 0.625 0 O-C-N 124.84 1.338 . . . . 0.0 109.205 -178.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . 0.507 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 23.2 Cg_exo -62.61 153.48 71.46 Favored 'Trans proline' 0 N--CA 1.447 -1.221 0 O-C-N 122.93 0.963 . . . . 0.0 114.253 178.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -69.62 112.8 3.15 Favored 'Trans proline' 0 C--N 1.363 1.338 0 N-CA-C 106.648 -2.097 . . . . 0.0 106.648 176.115 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.25 148.94 24.1 Favored 'General case' 0 C--N 1.343 0.303 0 CA-C-N 113.009 -1.905 . . . . 0.0 106.702 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 72.26 70.38 0.15 Allowed 'General case' 0 C--N 1.353 0.746 0 O-C-N 124.62 1.2 . . . . 0.0 109.117 -179.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -16.24 89.65 0.01 OUTLIER 'General case' 0 C--N 1.36 1.024 0 C-N-CA 127.634 2.373 . . . . 0.0 112.775 179.369 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.067 0 CA-C-N 112.835 -1.984 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.159 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -107.04 -5.65 17.95 Favored 'General case' 0 C--N 1.354 0.767 0 O-C-N 125.669 1.856 . . . . 0.0 115.56 -176.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.473 ' HB3' ' H ' ' A' ' 25' ' ' LEU . . . 51.31 -172.86 0.02 OUTLIER 'General case' 0 C--O 1.221 -0.398 0 CA-C-O 123.326 1.536 . . . . 0.0 113.881 178.169 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.454 ' O ' ' HB ' ' A' ' 53' ' ' ILE . 2.0 mt -157.42 -177.3 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 100.425 -3.917 . . . . 0.0 100.425 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -165.82 108.87 0.79 Allowed 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 102.389 -3.189 . . . . 0.0 102.389 177.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.9 mtmp? -90.01 -15.19 32.39 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 111.122 -2.763 . . . . 0.0 116.504 -175.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.439 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 32.8 m-85 -142.35 164.79 29.19 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 108.212 -1.032 . . . . 0.0 108.212 179.151 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -71.37 152.88 42.75 Favored 'General case' 0 C--N 1.359 0.999 0 C-N-CA 117.17 -1.812 . . . . 0.0 108.419 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -142.68 142.69 32.08 Favored 'General case' 0 CA--C 1.541 0.617 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 174.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 32.5 tptt -134.83 103.79 5.75 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 112.548 -2.115 . . . . 0.0 108.164 178.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.25 158.6 0.1 Allowed 'General case' 0 N--CA 1.482 1.15 0 CA-C-O 122.944 1.354 . . . . 0.0 114.199 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 30.0 p -119.09 -15.28 9.26 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 110.335 -3.121 . . . . 0.0 112.669 -179.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.16 170.08 21.4 Favored 'General case' 0 C--N 1.36 1.065 0 CA-C-O 123.316 1.531 . . . . 0.0 113.366 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -50.63 -34.79 27.56 Favored 'General case' 0 CA--C 1.555 1.159 0 CA-C-N 109.948 -3.296 . . . . 0.0 114.337 -179.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -92.19 -5.0 53.38 Favored 'General case' 0 C--N 1.355 0.828 0 N-CA-C 115.551 1.686 . . . . 0.0 115.551 -176.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -108.86 156.5 19.59 Favored 'General case' 0 C--O 1.222 -0.377 0 O-C-N 124.826 1.329 . . . . 0.0 108.936 -179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.444 HD23 ' C ' ' A' ' 45' ' ' ASP 0.265 2.9 pp -137.79 156.04 48.38 Favored 'General case' 0 N--CA 1.484 1.239 0 CA-C-N 112.718 -2.037 . . . . 0.0 111.121 177.831 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 73.4 m -84.42 170.54 13.45 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 111.913 -2.403 . . . . 0.0 115.484 -178.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 6.1 p90 -163.53 175.56 10.58 Favored 'General case' 0 C--N 1.352 0.699 0 CA-C-N 109.461 -3.518 . . . . 0.0 107.586 175.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mtmt -136.53 143.18 43.58 Favored 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 112.777 -2.01 . . . . 0.0 106.388 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 4.7 tmm_? -44.08 98.05 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.28 0 O-C-N 126.247 2.217 . . . . 0.0 112.957 -178.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 140.34 -23.24 2.71 Favored Glycine 0 CA--C 1.543 1.81 0 CA-C-N 113.428 -1.714 . . . . 0.0 114.992 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 89.4 m-20 -51.22 145.84 7.48 Favored 'General case' 0 C--N 1.363 1.154 0 N-CA-C 116.099 1.888 . . . . 0.0 116.099 -176.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mp -104.34 112.77 39.24 Favored 'Isoleucine or valine' 0 C--N 1.346 0.456 0 N-CA-C 102.188 -3.264 . . . . 0.0 102.188 173.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.565 HD22 HD13 ' A' ' 48' ' ' ILE . 6.3 mp -104.95 167.76 9.5 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 116.146 -2.222 . . . . 0.0 112.923 -176.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.72 109.15 20.97 Favored 'General case' 0 C--O 1.214 -0.813 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 176.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.402 HG23 ' HB2' ' A' ' 3' ' ' ALA . 71.1 t -87.78 97.02 6.19 Favored 'Isoleucine or valine' 0 C--N 1.357 0.927 0 C-N-CA 114.888 -2.725 . . . . 0.0 107.874 -177.21 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -93.15 98.53 11.36 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 111.955 -2.384 . . . . 0.0 107.484 179.247 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 14.9 m120 66.99 147.98 0.05 OUTLIER 'General case' 0 CA--C 1.561 1.385 0 CA-C-N 112.636 -2.075 . . . . 0.0 111.82 -179.058 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -150.95 91.03 1.66 Allowed 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 110.875 -2.875 . . . . 0.0 108.912 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -169.78 92.86 0.24 Allowed 'General case' 0 N--CA 1.437 -1.114 0 N-CA-C 107.102 -1.444 . . . . 0.0 107.102 -178.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 9.0 p -175.91 -46.18 0.01 OUTLIER 'General case' 0 C--N 1.352 0.687 0 CA-C-N 114.094 -1.412 . . . . 0.0 111.911 -178.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -160.66 110.83 1.76 Allowed 'General case' 0 C--N 1.359 0.999 0 C-N-CA 119.047 -1.061 . . . . 0.0 109.618 -178.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 -64.46 108.77 1.74 Allowed 'General case' 0 C--N 1.355 0.827 0 N-CA-C 105.544 -2.021 . . . . 0.0 105.544 178.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.4 m120 142.04 -14.43 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.589 0 O-C-N 126.981 2.675 . . . . 0.0 109.913 -177.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.5 m95 -136.49 161.31 36.21 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.776 0.798 . . . . 0.0 110.85 -177.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -133.71 150.92 51.52 Favored 'General case' 0 C--N 1.355 0.819 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 177.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 40.7 tttt -102.68 119.16 38.35 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 106.044 -1.836 . . . . 0.0 106.044 176.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -141.0 170.11 16.34 Favored 'General case' 0 C--N 1.356 0.883 0 C-N-CA 118.273 -1.371 . . . . 0.0 113.401 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 tm-20 -110.57 138.55 46.82 Favored 'General case' 0 C--N 1.362 1.116 0 CA-C-N 112.871 -1.968 . . . . 0.0 110.64 179.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.507 HD11 HD21 ' A' ' 25' ' ' LEU 0.281 12.1 mt -160.02 138.24 10.19 Favored 'General case' 0 CA--C 1.502 -0.88 0 CA-C-N 112.709 -2.041 . . . . 0.0 112.977 179.131 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 56.92 21.9 6.62 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 116.191 -2.203 . . . . 0.0 115.658 168.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 92.51 -9.06 76.58 Favored Glycine 0 CA--C 1.546 1.988 0 N-CA-C 115.37 0.908 . . . . 0.0 115.37 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 36.9 mttp -113.25 170.05 8.5 Favored 'General case' 0 C--N 1.355 0.827 0 N-CA-C 107.162 -1.421 . . . . 0.0 107.162 179.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.444 ' C ' HD23 ' A' ' 17' ' ' LEU . 19.9 t70 -140.94 131.17 24.92 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 113.119 -1.855 . . . . 0.0 106.303 -179.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.96 173.37 45.57 Favored Glycine 0 C--N 1.349 1.267 0 C-N-CA 116.401 -2.809 . . . . 0.0 113.217 -177.507 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -76.77 139.34 40.37 Favored 'General case' 0 CA--C 1.549 0.919 0 CA-C-O 123.653 1.692 . . . . 0.0 109.511 -179.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.565 HD13 HD22 ' A' ' 25' ' ' LEU . 1.0 OUTLIER -139.99 143.1 32.93 Favored Pre-proline 0 C--N 1.347 0.498 0 CA-C-N 110.8 -2.909 . . . . 0.0 106.462 179.471 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -74.76 143.75 30.31 Favored 'Trans proline' 0 C--N 1.361 1.216 0 N-CA-C 115.07 1.142 . . . . 0.0 115.07 -175.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 15.6 pttt -71.9 -33.85 68.65 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 116.072 -2.251 . . . . 0.0 113.947 -178.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 13.3 p-10 -62.11 -19.66 63.23 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-N 115.077 -0.965 . . . . 0.0 113.144 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -93.35 -13.34 28.22 Favored 'General case' 0 CA--C 1.566 1.591 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 179.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.502 HG21 ' CD1' ' A' ' 48' ' ' ILE . 0.1 OUTLIER -126.86 173.25 12.79 Favored 'Isoleucine or valine' 0 C--N 1.368 1.401 0 CA-C-O 121.808 0.813 . . . . 0.0 111.115 -178.338 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.494 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 0.2 OUTLIER -131.41 137.15 48.55 Favored 'General case' 0 C--N 1.358 0.971 0 CA-C-N 112.691 -2.05 . . . . 0.0 107.494 178.163 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 62.2 mtm -84.57 157.83 21.1 Favored 'General case' 0 C--N 1.343 0.301 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 178.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 20.7 mmtp -152.12 95.14 3.2 Favored Pre-proline 0 CA--C 1.545 0.765 0 CA-C-N 113.961 -1.472 . . . . 0.0 111.915 -179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 C--N 1.372 1.774 0 C-N-CA 122.001 1.8 . . . . 0.0 112.095 176.538 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.223 -0.304 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 74.5 t -122.4 93.34 48.56 Favored Pre-proline 0 C--N 1.346 0.427 0 O-C-N 125.218 1.574 . . . . 0.0 106.895 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . 0.439 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 5.0 Cg_exo -64.39 159.95 41.54 Favored 'Trans proline' 0 CA--C 1.573 2.431 0 N-CA-C 116.069 1.527 . . . . 0.0 116.069 177.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -52.6 156.35 8.87 Favored 'Trans proline' 0 C--N 1.373 1.831 0 C-N-CA 123.953 3.102 . . . . 0.0 116.785 178.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -74.67 120.34 6.12 Favored 'Trans proline' 0 C--N 1.358 1.037 0 N-CA-C 106.287 -2.236 . . . . 0.0 106.287 176.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.477 HG12 ' HD2' ' B' ' 6' ' ' PRO . 2.5 t -66.02 149.95 97.14 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-N 113.555 -1.657 . . . . 0.0 109.908 -178.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . 0.477 ' HD2' HG12 ' B' ' 5' ' ' VAL . 15.7 Cg_exo -71.26 159.95 50.35 Favored 'Trans proline' 0 C--N 1.359 1.099 0 N-CA-C 116.749 1.788 . . . . 0.0 116.749 178.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -75.94 118.69 5.11 Favored 'Trans proline' 0 C--N 1.359 1.098 0 N-CA-C 107.157 -1.901 . . . . 0.0 107.157 174.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.497 ' H ' ' NE ' ' B' ' 8' ' ' ARG . 0.0 OUTLIER -98.32 156.58 16.66 Favored 'General case' 0 C--N 1.345 0.378 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 178.22 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 1.5 mmt180 71.31 69.69 0.17 Allowed 'General case' 0 C--N 1.345 0.406 0 CA-C-N 112.02 -2.354 . . . . 0.0 108.624 -178.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 42.6 mmm-85 3.2 79.17 0.0 OUTLIER 'General case' 0 C--N 1.354 0.766 0 C-N-CA 129.491 3.116 . . . . 0.0 113.324 178.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.097 0 CA-C-N 110.054 -3.248 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -111.36 148.68 32.47 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 111.976 -2.375 . . . . 0.0 106.199 -177.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.638 ' HB1' ' CD1' ' A' ' 53' ' ' ILE . . . -138.51 170.56 15.79 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 111.587 -2.551 . . . . 0.0 109.648 -179.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.452 ' H ' HG13 ' A' ' 53' ' ' ILE . 11.1 mt -156.63 110.02 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.806 0 CA-C-N 111.286 -2.688 . . . . 0.0 109.408 -176.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.573 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -68.17 122.13 17.64 Favored 'General case' 0 C--N 1.352 0.685 0 C-N-CA 116.073 -2.251 . . . . 0.0 109.375 178.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 13.9 mtmt -96.16 -23.01 16.94 Favored 'General case' 0 C--N 1.346 0.426 0 N-CA-C 113.561 0.949 . . . . 0.0 113.561 -179.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.553 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 17.6 m-85 -140.01 160.57 39.64 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 106.118 -1.808 . . . . 0.0 106.118 179.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -67.2 151.22 47.93 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.042 -1.435 . . . . 0.0 109.561 -178.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -143.77 139.3 29.33 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 176.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 4.1 tmtt? -126.45 96.88 4.83 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-N 111.964 -2.38 . . . . 0.0 109.677 -179.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -45.22 149.51 0.5 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-O 122.192 0.996 . . . . 0.0 113.387 -178.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 11.8 t -123.92 2.32 8.72 Favored 'General case' 0 C--N 1.354 0.772 0 CA-C-N 111.309 -2.678 . . . . 0.0 114.855 -179.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.4 163.84 39.21 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 118.399 -1.32 . . . . 0.0 110.363 -178.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -50.6 -39.17 49.23 Favored 'General case' 0 CA--C 1.558 1.266 0 CA-C-N 111.609 -2.541 . . . . 0.0 113.264 -178.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.6 p30 -88.9 1.07 55.97 Favored 'General case' 0 C--N 1.354 0.778 0 N-CA-C 116.421 2.008 . . . . 0.0 116.421 -176.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 mt-10 -113.66 153.14 29.42 Favored 'General case' 0 N--CA 1.472 0.645 0 O-C-N 124.633 1.208 . . . . 0.0 109.382 -179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.627 HD23 ' N ' ' A' ' 46' ' ' GLY . 0.6 OUTLIER -136.39 158.76 43.66 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-N 113.47 -1.695 . . . . 0.0 110.793 178.476 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.531 ' O ' HD12 ' A' ' 17' ' ' LEU . 15.7 m -84.2 170.83 13.36 Favored 'General case' 0 C--N 1.35 0.61 0 N-CA-C 116.933 2.197 . . . . 0.0 116.933 -177.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 16.5 p90 -163.83 170.55 16.7 Favored 'General case' 0 C--N 1.355 0.824 0 CA-C-N 109.07 -3.695 . . . . 0.0 109.863 176.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -135.45 118.29 16.2 Favored 'General case' 0 C--N 1.354 0.787 0 CA-C-N 112.57 -2.105 . . . . 0.0 110.57 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -14.51 74.48 0.0 OUTLIER 'General case' 0 CA--C 1.559 1.291 0 N-CA-C 116.837 2.162 . . . . 0.0 116.837 178.149 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.573 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 150.78 -16.74 0.94 Allowed Glycine 0 CA--C 1.537 1.427 0 CA-C-N 111.847 -2.433 . . . . 0.0 116.0 179.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.587 ' HB3' HD21 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -50.96 151.59 2.5 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 113.991 1.108 . . . . 0.0 113.991 -178.531 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.3 pt -98.71 108.68 22.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.393 0 N-CA-C 106.494 -1.669 . . . . 0.0 106.494 177.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.621 HD22 HD13 ' A' ' 48' ' ' ILE . 3.0 mp -104.75 157.36 17.25 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 116.443 -2.103 . . . . 0.0 110.804 -177.287 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -105.0 106.54 17.07 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 110.922 -2.854 . . . . 0.0 108.026 177.399 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 86.6 t -86.7 111.08 21.01 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 C-N-CA 115.216 -2.594 . . . . 0.0 106.099 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.742 ' O ' HD13 ' A' ' 28' ' ' LEU . 3.4 tm? -96.22 -16.16 21.59 Favored 'General case' 0 C--N 1.352 0.708 0 CA-C-N 112.592 -2.095 . . . . 0.0 113.844 -176.466 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 45.3 t-20 -168.33 112.0 0.6 Allowed 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 115.599 -2.441 . . . . 0.0 113.052 179.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -97.49 176.8 5.73 Favored 'General case' 0 C--N 1.356 0.856 0 CA-C-N 114.2 -1.364 . . . . 0.0 108.619 177.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 67.62 81.43 0.19 Allowed 'General case' 0 C--N 1.359 1.002 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 42.5 t -166.63 -29.71 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 112.972 -1.922 . . . . 0.0 112.267 179.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -172.96 69.79 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 106.547 -1.649 . . . . 0.0 106.547 178.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -31.7 78.96 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 131.284 3.834 . . . . 0.0 111.115 -177.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.406 ' HA ' ' CD ' ' A' ' 50' ' ' LYS . 22.3 m-20 156.76 -0.83 0.0 OUTLIER 'General case' 0 CA--C 1.562 1.441 0 O-C-N 127.238 2.836 . . . . 0.0 112.565 -176.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -135.39 169.58 17.27 Favored 'General case' 0 CA--C 1.552 1.022 0 CA-C-O 122.357 1.075 . . . . 0.0 109.66 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -137.97 139.62 39.8 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 113.235 -1.802 . . . . 0.0 106.715 177.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -98.76 115.52 28.94 Favored 'General case' 0 C--N 1.354 0.772 0 N-CA-C 100.393 -3.928 . . . . 0.0 100.393 176.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -139.49 176.23 8.89 Favored 'General case' 0 C--O 1.221 -0.435 0 O-C-N 125.044 1.465 . . . . 0.0 113.417 -173.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -120.02 148.32 43.71 Favored 'General case' 0 C--N 1.362 1.12 0 O-C-N 125.064 1.478 . . . . 0.0 111.118 -179.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.587 HD21 ' HB3' ' A' ' 23' ' ' ASP 0.302 9.4 mt -161.94 138.93 8.33 Favored 'General case' 0 CA--C 1.502 -0.9 0 CA-C-N 110.465 -3.061 . . . . 0.0 111.953 179.342 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 55.63 29.06 12.92 Favored 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 115.688 -2.405 . . . . 0.0 116.43 168.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 79.94 10.63 85.42 Favored Glycine 0 CA--C 1.546 2.019 0 C-N-CA 118.662 -1.732 . . . . 0.0 115.013 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 31.4 mttp -135.73 163.01 31.15 Favored 'General case' 0 C--O 1.217 -0.629 0 C-N-CA 124.597 1.159 . . . . 0.0 107.942 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 7.5 p-10 -141.41 139.73 33.51 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.708 -1.133 . . . . 0.0 108.419 -178.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.627 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -170.96 176.09 44.46 Favored Glycine 0 C--N 1.347 1.161 0 C-N-CA 118.477 -1.82 . . . . 0.0 110.591 -177.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -77.3 144.8 37.83 Favored 'General case' 0 C--N 1.354 0.801 0 CA-C-O 122.522 1.153 . . . . 0.0 110.708 -179.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.621 HD13 HD22 ' A' ' 25' ' ' LEU . 1.3 pt -144.42 139.29 15.48 Favored Pre-proline 0 C--N 1.352 0.677 0 CA-C-N 112.392 -2.185 . . . . 0.0 107.819 179.491 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -72.02 148.66 51.38 Favored 'Trans proline' 0 C--N 1.363 1.336 0 CA-C-N 120.018 1.042 . . . . 0.0 114.197 -176.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.406 ' CD ' ' HA ' ' A' ' 35' ' ' ASN . 18.6 ptmt -70.22 -41.69 73.29 Favored 'General case' 0 C--N 1.356 0.882 0 C-N-CA 115.136 -2.626 . . . . 0.0 111.395 -178.422 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.405 HD22 ' HB2' ' B' ' 3' ' ' PRO . 13.1 p-10 -57.46 -18.68 19.65 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 115.655 1.724 . . . . 0.0 115.655 -179.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.421 ' CE1' HG22 ' B' ' 5' ' ' VAL . 6.9 m-85 -91.63 -7.81 48.98 Favored 'General case' 0 C--N 1.355 0.843 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.191 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.638 ' CD1' ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -129.83 172.8 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.1 0 CA-C-O 122.184 0.992 . . . . 0.0 108.759 179.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.438 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 21.7 tt0 -129.47 131.74 46.76 Favored 'General case' 0 C--N 1.349 0.568 0 N-CA-C 104.756 -2.312 . . . . 0.0 104.756 176.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -86.74 170.81 11.43 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 113.556 -1.656 . . . . 0.0 110.599 178.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 14.4 mtmm -156.53 97.62 2.16 Favored Pre-proline 0 N--CA 1.447 -0.611 0 CA-C-N 110.904 -2.862 . . . . 0.0 105.771 178.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_endo . . . . . 0 CA--C 1.55 1.276 0 O-C-N 123.565 1.298 . . . . 0.0 114.609 -179.297 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.221 -0.401 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 47.2 t 31.56 91.57 0.05 OUTLIER Pre-proline 0 C--N 1.351 0.654 0 C-N-CA 127.485 2.314 . . . . 0.0 110.631 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . 0.553 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 2.7 Cg_endo -65.9 157.05 61.21 Favored 'Trans proline' 0 CA--C 1.579 2.73 0 N-CA-C 116.01 1.504 . . . . 0.0 116.01 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' B' ' 2' ' ' PRO . 36.0 Cg_exo -58.7 161.07 15.79 Favored 'Trans proline' 0 C--N 1.369 1.612 0 C-N-CA 123.594 2.863 . . . . 0.0 118.297 179.051 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 9.1 Cg_endo -71.45 117.92 5.4 Favored 'Trans proline' 0 C--N 1.37 1.69 0 N-CA-C 105.498 -2.539 . . . . 0.0 105.498 174.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.435 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 4.1 t -65.56 147.34 98.73 Favored Pre-proline 0 CA--C 1.551 0.997 0 CA-C-N 113.685 -1.598 . . . . 0.0 109.135 -178.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . 0.435 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 2.8 Cg_exo -68.1 159.64 52.19 Favored 'Trans proline' 0 C--N 1.363 1.329 0 N-CA-C 116.805 1.81 . . . . 0.0 116.805 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' PRO . . . . . 0.504 ' HG2' HH21 ' B' ' 10' ' ' ARG . 10.0 Cg_endo -76.28 119.81 5.42 Favored 'Trans proline' 0 CA--C 1.553 1.443 0 N-CA-C 107.785 -1.659 . . . . 0.0 107.785 175.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.34 168.45 10.56 Favored 'General case' 0 C--N 1.362 1.118 0 C-N-CA 118.495 -1.282 . . . . 0.0 109.879 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER 74.68 73.53 0.1 Allowed 'General case' 0 C--N 1.356 0.865 0 CA-C-N 113.139 -1.846 . . . . 0.0 107.95 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . 0.504 HH21 ' HG2' ' B' ' 7' ' ' PRO 0.339 0.0 OUTLIER -164.41 96.58 0.77 Allowed 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 112.529 -2.123 . . . . 0.0 110.419 178.097 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.129 0 CA-C-N 114.764 -1.107 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.452 -0.337 0 CA-C-O 121.997 0.903 . . . . 0.0 109.27 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -107.5 157.18 18.22 Favored 'General case' 0 N--CA 1.441 -0.904 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.515 -178.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.803 ' HB1' HD11 ' A' ' 53' ' ' ILE . . . -141.09 153.85 45.64 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 110.615 -2.993 . . . . 0.0 105.139 -179.095 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 22.7 mt -146.67 112.75 0.99 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.743 0 N-CA-C 104.924 -2.251 . . . . 0.0 104.924 -174.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.21 144.2 55.02 Favored 'General case' 0 CA--C 1.564 1.505 0 CA-C-N 112.033 -2.349 . . . . 0.0 110.715 -178.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 16.8 mtmt -98.95 -28.04 13.61 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 128.21 2.604 . . . . 0.0 113.205 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.507 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 58.8 m-85 -144.63 164.21 31.63 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 117.521 -1.672 . . . . 0.0 108.463 -179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -64.53 143.57 57.82 Favored 'General case' 0 C--N 1.352 0.686 0 CA-C-N 113.398 -1.728 . . . . 0.0 107.876 179.061 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 26.3 t80 -142.46 142.67 32.35 Favored 'General case' 0 C--N 1.346 0.44 0 CA-C-O 122.857 1.313 . . . . 0.0 107.902 177.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.25 115.55 16.47 Favored 'General case' 0 CA--C 1.56 1.332 0 CA-C-N 111.632 -2.531 . . . . 0.0 109.687 177.312 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -48.35 147.93 2.13 Favored 'General case' 0 N--CA 1.485 1.306 0 CA-C-O 121.372 0.606 . . . . 0.0 112.435 -177.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 72.7 p -121.96 -5.52 9.03 Favored 'General case' 0 C--N 1.353 0.74 0 CA-C-N 113.449 -1.705 . . . . 0.0 112.602 -178.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -151.55 165.34 34.55 Favored 'General case' 0 N--CA 1.482 1.132 0 CA-C-O 123.34 1.543 . . . . 0.0 110.287 -178.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.9 p30 -50.67 -35.99 33.57 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 110.28 -3.145 . . . . 0.0 115.453 -178.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 52.4 p-10 -93.23 0.9 57.22 Favored 'General case' 0 C--N 1.352 0.684 0 O-C-N 124.444 1.09 . . . . 0.0 113.811 -176.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -109.81 160.81 16.03 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 114.152 -1.385 . . . . 0.0 109.71 -179.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.765 HD11 ' HB2' ' A' ' 41' ' ' LEU . 0.3 OUTLIER -135.8 161.09 36.56 Favored 'General case' 0 CA--C 1.553 1.092 0 CA-C-N 113.754 -1.566 . . . . 0.0 110.109 179.813 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.531 ' O ' HD12 ' A' ' 17' ' ' LEU . 3.0 m -84.87 163.74 18.83 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 113.676 -1.602 . . . . 0.0 115.186 -179.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 50.9 p90 -164.41 160.46 20.7 Favored 'General case' 0 C--N 1.359 0.991 0 CA-C-N 110.85 -2.886 . . . . 0.0 109.788 174.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.36 119.36 16.42 Favored 'General case' 0 C--N 1.348 0.542 0 CA-C-N 114.07 -1.423 . . . . 0.0 110.671 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -4.04 92.58 0.01 OUTLIER 'General case' 0 C--N 1.363 1.154 0 C-N-CA 127.185 2.194 . . . . 0.0 114.23 -178.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 118.29 8.03 10.68 Favored Glycine 0 C--N 1.353 1.485 0 O-C-N 125.014 1.446 . . . . 0.0 116.252 178.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.566 ' HB3' HD21 ' A' ' 41' ' ' LEU . 59.5 m-20 -62.28 152.95 32.15 Favored 'General case' 0 C--N 1.355 0.806 0 C-N-CA 117.372 -1.731 . . . . 0.0 112.936 179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 83.6 mt -96.16 112.22 27.94 Favored 'Isoleucine or valine' 0 C--N 1.352 0.702 0 N-CA-C 104.895 -2.261 . . . . 0.0 104.895 178.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.809 HD11 HD11 ' A' ' 41' ' ' LEU . 0.3 OUTLIER -103.93 145.79 29.62 Favored 'General case' 0 C--N 1.352 0.706 0 CA-C-N 113.302 -1.772 . . . . 0.0 111.037 -176.027 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -114.12 113.03 24.15 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-N 111.714 -2.494 . . . . 0.0 108.429 177.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 6.4 t -86.35 108.03 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 115.106 -2.638 . . . . 0.0 111.404 -174.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.434 ' HA ' HD12 ' A' ' 28' ' ' LEU . 12.4 tp -91.79 -4.2 55.22 Favored 'General case' 0 C--N 1.351 0.641 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 -178.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -174.63 137.25 0.46 Allowed 'General case' 0 C--N 1.348 0.536 0 C-N-CA 117.827 -1.549 . . . . 0.0 107.667 -179.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -154.18 86.8 1.17 Allowed 'General case' 0 C--N 1.348 0.515 0 CA-C-N 113.714 -1.585 . . . . 0.0 108.541 -179.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.439 ' CG ' ' H ' ' A' ' 32' ' ' CYS . 2.1 tp10 -74.23 -151.88 0.03 OUTLIER 'General case' 0 N--CA 1.421 -1.892 0 CA-C-N 112.903 -1.953 . . . . 0.0 106.663 178.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.439 ' H ' ' CG ' ' A' ' 31' ' ' GLU . 87.1 m -81.66 -9.42 59.66 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 112.656 -2.065 . . . . 0.0 112.144 -177.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -64.27 106.87 1.18 Allowed 'General case' 0 C--N 1.374 1.664 0 C-N-CA 117.339 -1.744 . . . . 0.0 109.694 -178.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -92.11 106.78 18.72 Favored 'General case' 0 C--N 1.356 0.887 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 178.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.1 m-20 141.62 -13.64 0.0 OUTLIER 'General case' 0 CA--C 1.548 0.882 0 O-C-N 126.853 2.596 . . . . 0.0 111.624 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.7 m95 -139.0 154.84 48.3 Favored 'General case' 0 CA--C 1.549 0.915 0 CA-C-O 121.316 0.579 . . . . 0.0 110.373 -177.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 31.6 m-85 -136.15 137.57 41.09 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 104.728 -2.323 . . . . 0.0 104.728 175.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -98.78 117.48 33.35 Favored 'General case' 0 C--N 1.353 0.723 0 N-CA-C 105.212 -2.144 . . . . 0.0 105.212 176.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -138.38 174.95 10.0 Favored 'General case' 0 C--N 1.352 0.68 0 O-C-N 124.346 1.029 . . . . 0.0 111.793 -176.524 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.5 132.15 52.85 Favored 'General case' 0 C--N 1.359 1.018 0 O-C-N 124.482 1.114 . . . . 0.0 110.23 -178.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.809 HD11 HD11 ' A' ' 25' ' ' LEU 0.257 9.8 mt -159.84 145.8 15.77 Favored 'General case' 0 C--N 1.36 1.025 0 CA-C-N 111.482 -2.599 . . . . 0.0 114.736 178.739 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 56.26 28.27 13.03 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 110.723 -2.944 . . . . 0.0 115.011 170.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.9 11.54 82.53 Favored Glycine 0 CA--C 1.541 1.688 0 C-N-CA 119.612 -1.28 . . . . 0.0 114.509 179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.9 mmmp? -138.51 -177.89 5.05 Favored 'General case' 0 C--N 1.349 0.583 0 CA-C-O 122.566 1.174 . . . . 0.0 110.225 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -141.93 133.07 26.2 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 112.232 -2.258 . . . . 0.0 105.556 -179.445 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.427 ' CA ' HD23 ' A' ' 17' ' ' LEU . . . -173.05 173.65 45.68 Favored Glycine 0 C--N 1.338 0.688 0 C-N-CA 117.437 -2.316 . . . . 0.0 111.834 -178.202 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -77.73 146.61 35.83 Favored 'General case' 0 CA--C 1.56 1.356 0 CA-C-N 112.54 -1.83 . . . . 0.0 110.665 179.313 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 10.9 pt -143.79 144.75 28.16 Favored Pre-proline 0 C--N 1.352 0.711 0 CA-C-N 111.414 -2.63 . . . . 0.0 107.475 177.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -80.18 138.61 12.81 Favored 'Trans proline' 0 C--N 1.367 1.534 0 N-CA-C 114.808 1.042 . . . . 0.0 114.808 -177.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -71.52 -35.06 70.58 Favored 'General case' 0 C--N 1.354 0.768 0 CA-C-O 117.009 -1.472 . . . . 0.0 113.009 -178.44 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.277 0.5 OUTLIER -63.03 -10.71 15.06 Favored 'General case' 0 CA--C 1.562 1.409 0 C-N-CA 113.046 -3.462 . . . . 0.0 112.834 178.146 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -94.67 -15.08 24.25 Favored 'General case' 0 CA--C 1.555 1.159 0 CA-C-O 117.47 -1.253 . . . . 0.0 108.942 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.803 HD11 ' HB1' ' A' ' 3' ' ' ALA . 0.0 OUTLIER -133.98 160.56 41.81 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-O 122.901 1.334 . . . . 0.0 111.111 178.481 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.449 ' H ' HG12 ' A' ' 53' ' ' ILE . 18.3 tt0 -126.9 145.01 50.83 Favored 'General case' 0 C--N 1.346 0.424 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 178.048 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.13 162.31 18.45 Favored 'General case' 0 C--N 1.343 0.324 0 CA-C-N 114.189 -1.369 . . . . 0.0 110.261 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.77 92.49 3.62 Favored Pre-proline 0 CA--C 1.546 0.801 0 CA-C-N 112.825 -1.989 . . . . 0.0 108.203 -179.414 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo . . . . . 0 C--N 1.363 1.293 0 C-N-CA 121.166 1.244 . . . . 0.0 111.768 179.054 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.225 -0.229 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 61.9 t -99.33 111.55 61.43 Favored Pre-proline 0 C--N 1.348 0.54 0 O-C-N 125.457 1.723 . . . . 0.0 107.621 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . 0.507 ' HB3' ' CD2' ' A' ' 7' ' ' TYR . 3.2 Cg_exo -71.24 164.17 36.66 Favored 'Trans proline' 0 CA--C 1.571 2.331 0 N-CA-C 116.494 1.69 . . . . 0.0 116.494 176.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_exo -50.6 160.18 1.83 Allowed 'Trans proline' 0 C--N 1.372 1.816 0 C-N-CA 124.499 3.466 . . . . 0.0 118.74 179.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -75.69 112.77 3.59 Favored 'Trans proline' 0 C--N 1.357 1.02 0 N-CA-C 106.621 -2.107 . . . . 0.0 106.621 176.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 3.5 t -58.26 143.61 79.08 Favored Pre-proline 0 CA--C 1.551 0.984 0 CA-C-N 113.256 -1.793 . . . . 0.0 109.824 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_exo -61.2 150.31 85.16 Favored 'Trans proline' 0 C--N 1.359 1.117 0 O-C-N 122.789 0.889 . . . . 0.0 114.067 179.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_endo -67.68 111.78 2.46 Favored 'Trans proline' 0 C--N 1.364 1.391 0 N-CA-C 107.713 -1.687 . . . . 0.0 107.713 177.064 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.63 96.92 7.01 Favored 'General case' 0 C--N 1.353 0.761 0 N-CA-C 105.7 -1.963 . . . . 0.0 105.7 -178.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 6.0 mtp85 -160.88 62.13 0.3 Allowed 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 112.178 -2.283 . . . . 0.0 111.466 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 174.28 132.74 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 113.43 -1.713 . . . . 0.0 106.384 178.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 0.413 0 CA-C-N 114.489 -1.232 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.475 ' HG2' HG11 ' A' ' 27' ' ' VAL . 1.0 OUTLIER . . . . . 0 N--CA 1.465 0.279 0 CA-C-O 121.81 0.814 . . . . 0.0 109.488 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -105.86 143.85 33.41 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 112.719 -2.037 . . . . 0.0 105.633 -177.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.692 ' HB1' HD12 ' A' ' 53' ' ' ILE . . . -133.77 156.53 47.82 Favored 'General case' 0 C--N 1.351 0.656 0 CA-C-N 112.33 -2.214 . . . . 0.0 109.132 -177.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 49.1 mt -145.01 117.42 2.34 Favored 'Isoleucine or valine' 0 C--N 1.354 0.783 0 CA-C-N 112.647 -2.07 . . . . 0.0 109.762 -176.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -69.43 125.22 26.04 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 117.296 -1.762 . . . . 0.0 108.311 177.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -95.9 -24.95 16.18 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 114.521 -1.218 . . . . 0.0 114.139 -178.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.588 ' CD2' ' HB3' ' B' ' 2' ' ' PRO . 41.6 m-85 -142.49 165.65 26.83 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 106.637 -1.616 . . . . 0.0 106.637 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -68.84 157.97 35.42 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 116.69 -2.004 . . . . 0.0 109.173 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.488 ' HE1' HG21 ' B' ' 5' ' ' VAL . 12.6 t80 -145.96 142.78 29.02 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 118.554 -1.258 . . . . 0.0 108.895 175.366 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -129.44 100.96 5.75 Favored 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 127.333 2.253 . . . . 0.0 108.993 179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.93 160.26 0.04 OUTLIER 'General case' 0 C--N 1.352 0.696 0 CA-C-O 123.079 1.419 . . . . 0.0 113.862 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.7 p -117.12 -25.63 7.08 Favored 'General case' 0 CA--C 1.557 1.247 0 CA-C-N 110.648 -2.978 . . . . 0.0 112.348 -178.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.73 168.15 26.63 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 117.096 -1.842 . . . . 0.0 110.628 -177.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -42.54 -40.58 2.7 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-N 109.949 -3.296 . . . . 0.0 114.352 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.9 p-10 -85.83 0.86 51.87 Favored 'General case' 0 CA--C 1.559 1.3 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 -177.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 18.7 mt-10 -112.13 155.84 23.26 Favored 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 178.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.553 HD12 ' C ' ' A' ' 17' ' ' LEU . 1.4 pp -136.63 155.58 49.71 Favored 'General case' 0 C--N 1.345 0.411 0 CA-C-N 113.371 -1.74 . . . . 0.0 108.422 178.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 22.0 m -87.15 173.17 9.41 Favored 'General case' 0 CA--C 1.47 -2.125 0 N-CA-C 119.274 3.065 . . . . 0.0 119.274 -177.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -162.88 -175.6 4.48 Favored 'General case' 0 C--N 1.354 0.764 0 CA-C-N 108.532 -3.94 . . . . 0.0 108.625 175.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.73 140.58 34.88 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-N 112.328 -2.214 . . . . 0.0 105.95 -179.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.81 101.57 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.875 0 O-C-N 124.974 1.421 . . . . 0.0 111.63 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 136.3 -25.04 3.19 Favored Glycine 0 C--N 1.355 1.59 0 CA-C-N 113.96 -1.473 . . . . 0.0 114.232 -178.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -58.38 145.86 36.81 Favored 'General case' 0 C--N 1.36 1.06 0 C-N-CA 117.036 -1.865 . . . . 0.0 112.8 -177.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.2 mm -97.58 113.95 33.46 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.358 0 N-CA-C 103.398 -2.815 . . . . 0.0 103.398 178.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.612 ' CD1' HD11 ' A' ' 41' ' ' LEU . 1.4 mm? -100.96 162.78 12.65 Favored 'General case' 0 C--N 1.355 0.828 0 C-N-CA 116.241 -2.184 . . . . 0.0 109.697 -175.463 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -103.31 111.07 23.31 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 108.949 -3.751 . . . . 0.0 105.903 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.674 ' CG2' ' HB2' ' A' ' 3' ' ' ALA . 90.1 t -87.83 100.34 10.07 Favored 'Isoleucine or valine' 0 C--N 1.342 0.275 0 C-N-CA 116.391 -2.124 . . . . 0.0 111.259 -175.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -95.5 90.1 5.64 Favored 'General case' 0 C--N 1.349 0.579 0 N-CA-C 106.835 -1.543 . . . . 0.0 106.835 177.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.6 m-20 57.66 -177.46 0.06 Allowed 'General case' 0 CA--C 1.554 1.122 0 CA-C-N 113.306 -1.77 . . . . 0.0 112.737 178.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -158.26 115.07 2.84 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 110.643 -2.981 . . . . 0.0 106.365 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.42 ' O ' ' CB ' ' A' ' 32' ' ' CYS . 6.0 pt-20 -171.5 116.92 0.42 Allowed 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 118.203 -1.399 . . . . 0.0 108.302 -178.126 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.42 ' CB ' ' O ' ' A' ' 31' ' ' GLU . 2.0 t 149.76 -51.85 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 113.486 -1.688 . . . . 0.0 110.786 179.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -159.11 116.97 2.81 Favored 'General case' 0 C--N 1.359 0.987 0 C-N-CA 117.47 -1.692 . . . . 0.0 111.932 179.284 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 30.8 tt0 -61.74 107.63 0.86 Allowed 'General case' 0 C--N 1.351 0.638 0 N-CA-C 105.598 -2.001 . . . . 0.0 105.598 179.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 31.6 m-20 145.1 -11.2 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.074 0 O-C-N 128.046 3.341 . . . . 0.0 113.004 -174.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 68.6 m95 -136.39 161.01 37.02 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.997 0.903 . . . . 0.0 109.517 -177.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 28.8 m-85 -131.91 145.1 51.31 Favored 'General case' 0 C--N 1.345 0.381 0 CA-C-N 112.926 -1.943 . . . . 0.0 106.4 178.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 38.8 tttm -101.65 121.27 41.71 Favored 'General case' 0 C--N 1.348 0.523 0 N-CA-C 105.852 -1.906 . . . . 0.0 105.852 177.285 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -142.29 176.4 9.02 Favored 'General case' 0 C--N 1.348 0.529 0 C-N-CA 118.719 -1.192 . . . . 0.0 113.464 -176.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -120.73 140.18 52.02 Favored 'General case' 0 C--O 1.203 -1.362 0 CA-C-O 123.608 1.67 . . . . 0.0 111.879 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.612 HD11 ' CD1' ' A' ' 25' ' ' LEU 0.29 16.1 mt -162.14 154.66 19.65 Favored 'General case' 0 C--O 1.189 -2.109 0 CA-C-N 110.033 -3.258 . . . . 0.0 114.005 178.055 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 48.69 23.4 0.64 Allowed 'General case' 0 CA--C 1.555 1.163 0 O-C-N 127.163 2.79 . . . . 0.0 116.237 169.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 86.94 -5.43 85.13 Favored Glycine 0 CA--C 1.559 2.825 0 N-CA-C 116.439 1.336 . . . . 0.0 116.439 -178.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.9 mtmt -118.57 173.43 6.85 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 123.163 1.459 . . . . 0.0 107.811 177.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.548 ' C ' HD23 ' A' ' 17' ' ' LEU . 35.0 p-10 -142.6 133.31 25.37 Favored 'General case' 0 CA--C 1.541 0.614 0 CA-C-N 111.7 -2.5 . . . . 0.0 106.8 179.651 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.42 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -169.36 178.03 42.69 Favored Glycine 0 C--N 1.346 1.124 0 C-N-CA 117.091 -2.48 . . . . 0.0 111.344 -178.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -77.46 146.96 36.16 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 118.62 -1.232 . . . . 0.0 112.684 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 21.1 pt -142.29 137.74 15.93 Favored Pre-proline 0 C--N 1.359 0.999 0 CA-C-N 112.62 -2.082 . . . . 0.0 107.506 177.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_endo -70.38 147.89 59.88 Favored 'Trans proline' 0 C--N 1.356 0.955 0 N-CA-C 114.339 0.861 . . . . 0.0 114.339 -176.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 12.8 ptmm? -71.11 -43.29 67.94 Favored 'General case' 0 C--N 1.36 1.05 0 C-N-CA 116.597 -2.041 . . . . 0.0 111.371 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.418 HD22 ' HB2' ' B' ' 3' ' ' PRO . 8.0 p-10 -53.91 -23.99 14.63 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 178.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.618 ' CE1' HG22 ' B' ' 5' ' ' VAL . 6.4 m-85 -89.54 -3.23 58.42 Favored 'General case' 0 CA--C 1.561 1.379 0 C-N-CA 118.986 -1.086 . . . . 0.0 111.518 -179.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.692 HD12 ' HB1' ' A' ' 3' ' ' ALA . 0.1 OUTLIER -129.54 173.61 13.76 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.142 0 CA-C-N 119.64 1.109 . . . . 0.0 108.909 178.775 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.413 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 31.3 tt0 -129.81 121.03 25.98 Favored 'General case' 0 C--N 1.347 0.49 0 N-CA-C 103.487 -2.783 . . . . 0.0 103.487 178.148 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -87.36 160.63 18.3 Favored 'General case' 0 C--N 1.345 0.373 0 CA-C-N 113.143 -1.844 . . . . 0.0 112.143 -179.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -154.61 80.92 4.49 Favored Pre-proline 0 CA--C 1.55 0.946 0 CA-C-N 112.595 -2.093 . . . . 0.0 109.533 177.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo . . . . . 0 C--N 1.367 1.54 0 C-N-CA 121.074 1.183 . . . . 0.0 110.584 179.231 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.376 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 5.3 p -97.56 119.66 62.24 Favored Pre-proline 0 CA--C 1.539 0.531 0 O-C-N 124.917 1.386 . . . . 0.0 108.322 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . 0.588 ' HB3' ' CD2' ' A' ' 7' ' ' TYR 0.258 3.4 Cg_exo -70.22 151.71 66.55 Favored 'Trans proline' 0 N--CA 1.431 -2.195 0 N-CA-C 115.186 1.187 . . . . 0.0 115.186 176.851 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.418 ' HB2' HD22 ' A' ' 51' ' ' ASN . 51.5 Cg_exo -45.91 155.52 0.56 Allowed 'Trans proline' 0 C--N 1.368 1.586 0 C-N-CA 123.127 2.551 . . . . 0.0 116.518 -179.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -76.0 105.82 2.15 Favored 'Trans proline' 0 C--N 1.366 1.484 0 N-CA-C 106.256 -2.248 . . . . 0.0 106.256 178.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.618 HG22 ' CE1' ' A' ' 52' ' ' TYR . 4.2 t -50.36 146.13 9.37 Favored Pre-proline 0 CA--C 1.559 1.314 0 CA-C-N 113.492 -1.686 . . . . 0.0 110.639 -178.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -66.69 155.66 69.4 Favored 'Trans proline' 0 C--N 1.365 1.44 0 C-N-CA 120.937 1.091 . . . . 0.0 113.854 178.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -73.37 110.29 3.03 Favored 'Trans proline' 0 C--N 1.356 0.928 0 N-CA-C 106.164 -2.283 . . . . 0.0 106.164 176.492 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.17 94.67 4.12 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 116.747 -1.981 . . . . 0.0 106.247 -179.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 4.9 ttm180 -141.63 -77.48 0.28 Allowed 'General case' 0 N--CA 1.425 -1.716 0 CA-C-N 111.062 -2.79 . . . . 0.0 109.187 -179.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -174.46 90.81 0.07 Allowed 'General case' 0 N--CA 1.434 -1.233 1 CA-C-N 108.307 -4.042 . . . . 0.0 109.385 -179.871 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.268 0 CA-C-N 114.071 -1.422 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.535 0.397 0 CA-C-O 121.445 0.641 . . . . 0.0 110.904 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -100.66 152.81 20.0 Favored 'General case' 0 C--N 1.363 1.175 0 N-CA-C 105.557 -2.016 . . . . 0.0 105.557 176.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.759 ' HB2' HG13 ' A' ' 27' ' ' VAL . . . -136.65 152.69 50.69 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 111.903 -2.408 . . . . 0.0 108.497 -178.043 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 48.2 mt -150.19 122.6 1.32 Allowed 'Isoleucine or valine' 0 C--N 1.352 0.706 0 CA-C-N 113.239 -1.8 . . . . 0.0 109.784 -175.809 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.517 ' HB3' ' H ' ' A' ' 22' ' ' GLY . . . -67.04 127.57 33.07 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 113.31 -1.768 . . . . 0.0 110.788 178.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -93.12 -24.14 18.37 Favored 'General case' 0 CA--C 1.558 1.274 0 CA-C-N 113.887 -1.506 . . . . 0.0 112.577 178.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -141.34 166.5 24.6 Favored 'General case' 0 C--N 1.355 0.836 0 N-CA-C 107.487 -1.301 . . . . 0.0 107.487 179.019 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -68.86 156.21 38.84 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 116.689 -2.004 . . . . 0.0 108.176 178.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -146.24 138.82 25.39 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 174.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.407 ' O ' ' CD ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -129.39 103.24 6.8 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 106.506 -1.664 . . . . 0.0 106.506 177.266 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -46.96 157.62 0.15 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 122.954 1.359 . . . . 0.0 112.236 -179.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 10.1 t -148.29 20.82 1.08 Allowed 'General case' 0 CA--C 1.565 1.548 0 CA-C-N 111.073 -2.785 . . . . 0.0 114.19 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -152.84 140.7 20.11 Favored 'General case' 0 C--N 1.348 0.527 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -43.08 -32.85 0.75 Allowed 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 114.131 -1.395 . . . . 0.0 114.048 179.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 53.8 p30 -92.54 -4.59 53.26 Favored 'General case' 0 CA--C 1.568 1.663 0 N-CA-C 116.085 1.883 . . . . 0.0 116.085 -178.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -107.34 154.74 20.84 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 121.89 0.852 . . . . 0.0 108.849 -178.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.3 pp -133.3 158.72 42.24 Favored 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 112.481 -2.145 . . . . 0.0 111.161 178.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . . . . . . . . . 15.7 m -85.75 171.63 11.45 Favored 'General case' 0 C--N 1.35 0.601 0 N-CA-C 117.191 2.293 . . . . 0.0 117.191 -178.313 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 17.4 p90 -164.36 166.53 20.67 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-N 109.827 -3.352 . . . . 0.0 109.115 174.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -134.96 111.72 10.05 Favored 'General case' 0 CA--C 1.557 1.236 0 CA-C-N 114.442 -1.254 . . . . 0.0 110.367 178.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -3.88 93.23 0.01 OUTLIER 'General case' 0 CA--C 1.557 1.227 0 C-N-CA 127.516 2.326 . . . . 0.0 113.962 -179.34 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.517 ' H ' ' HB3' ' A' ' 5' ' ' ALA . . . 120.38 3.7 11.4 Favored Glycine 0 CA--C 1.547 2.034 0 CA-C-N 113.688 -1.596 . . . . 0.0 116.495 179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.523 ' HB3' HD21 ' A' ' 41' ' ' LEU . 59.8 m-20 -59.12 155.45 13.89 Favored 'General case' 0 C--N 1.35 0.621 0 CA-C-O 122.58 1.181 . . . . 0.0 113.196 -178.074 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.6 pt -96.93 103.92 15.26 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.319 0 CA-C-N 111.16 -2.745 . . . . 0.0 104.851 178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.606 HD21 HD11 ' A' ' 41' ' ' LEU . 0.9 OUTLIER -108.05 158.95 16.95 Favored 'General case' 0 C--N 1.349 0.587 0 CA-C-N 113.804 -1.543 . . . . 0.0 110.812 -176.181 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.73 109.64 14.49 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 112.295 -2.23 . . . . 0.0 107.192 177.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.759 HG13 ' HB2' ' A' ' 3' ' ' ALA . 1.8 m -85.88 114.98 26.49 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 C-N-CA 117.099 -1.84 . . . . 0.0 110.24 -176.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.585 ' O ' HD13 ' A' ' 28' ' ' LEU . 1.3 tm? -88.81 -8.47 54.3 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 111.828 -2.442 . . . . 0.0 117.015 -179.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -177.0 164.32 2.27 Favored 'General case' 0 C--N 1.351 0.662 0 C-N-CA 119.385 -0.926 . . . . 0.0 109.141 -178.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -168.62 77.14 0.12 Allowed 'General case' 0 C--N 1.348 0.527 0 C-N-CA 115.456 -2.498 . . . . 0.0 111.744 -178.093 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 174.93 48.31 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.987 0 CA-C-N 111.872 -2.422 . . . . 0.0 110.241 -179.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 44.6 m -100.5 -54.45 2.84 Favored 'General case' 0 C--N 1.351 0.657 0 CA-C-N 114.52 -1.218 . . . . 0.0 112.379 -177.12 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 39.5 m-20 -165.35 74.39 0.22 Allowed 'General case' 0 C--N 1.348 0.538 0 O-C-N 125.748 1.905 . . . . 0.0 107.793 -179.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -17.61 90.82 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 128.384 2.673 . . . . 0.0 112.581 179.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 7.2 m120 146.62 -1.61 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 131.583 3.953 . . . . 0.0 114.87 -171.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 75.1 m95 -139.96 168.47 19.73 Favored 'General case' 0 CA--C 1.549 0.906 0 CA-C-O 121.535 0.684 . . . . 0.0 109.406 -176.909 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 21.8 m-85 -140.87 150.1 42.8 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 114.396 -1.274 . . . . 0.0 107.841 176.09 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -103.99 117.95 35.51 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 105.397 -2.075 . . . . 0.0 105.397 176.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -140.5 176.62 8.63 Favored 'General case' 0 CA--C 1.544 0.721 0 O-C-N 123.982 0.801 . . . . 0.0 112.399 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -112.03 135.75 52.28 Favored 'General case' 0 C--N 1.364 1.21 0 O-C-N 123.89 0.743 . . . . 0.0 109.728 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.606 HD11 HD21 ' A' ' 25' ' ' LEU . 18.5 mt -160.36 143.67 13.64 Favored 'General case' 0 CA--C 1.468 -2.181 0 C-N-CA 126.864 2.066 . . . . 0.0 115.685 -178.934 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 55.25 32.31 18.33 Favored 'General case' 0 CA--C 1.56 1.343 0 C-N-CA 115.358 -2.537 . . . . 0.0 115.967 168.437 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 81.1 -4.92 68.61 Favored Glycine 0 CA--C 1.558 2.774 0 C-N-CA 119.891 -1.147 . . . . 0.0 115.696 -178.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -124.0 -175.68 3.29 Favored 'General case' 0 C--N 1.352 0.705 0 CA-C-O 122.983 1.373 . . . . 0.0 109.505 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -142.48 134.25 26.9 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 111.61 -2.541 . . . . 0.0 104.789 178.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -172.45 175.5 45.59 Favored Glycine 0 C--N 1.35 1.317 0 C-N-CA 116.373 -2.822 . . . . 0.0 112.215 -177.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -77.49 143.67 38.31 Favored 'General case' 0 C--N 1.358 0.973 0 C-N-CA 117.927 -1.509 . . . . 0.0 112.014 -177.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.711 HD12 HG21 ' A' ' 53' ' ' ILE . 3.8 pt -142.57 144.59 30.98 Favored Pre-proline 0 C--N 1.356 0.865 0 CA-C-N 112.064 -2.335 . . . . 0.0 107.817 179.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -77.79 155.38 30.79 Favored 'Trans proline' 0 CA--C 1.547 1.126 0 N-CA-C 118.471 2.451 . . . . 0.0 118.471 -177.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.7 mttt -68.61 -56.5 8.03 Favored 'General case' 0 C--N 1.36 1.042 0 CA-C-N 112.651 -2.068 . . . . 0.0 110.261 178.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . 0.321 0.7 OUTLIER -59.19 -8.34 1.55 Allowed 'General case' 0 CA--C 1.56 1.339 0 C-N-CA 115.28 -2.568 . . . . 0.0 115.683 -179.752 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -95.07 -11.54 28.13 Favored 'General case' 0 CA--C 1.567 1.622 0 CA-C-O 117.642 -1.17 . . . . 0.0 113.55 175.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.711 HG21 HD12 ' A' ' 48' ' ' ILE . 0.1 OUTLIER -133.15 166.56 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.496 0 CA-C-N 120.368 1.44 . . . . 0.0 110.159 -178.915 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.404 ' N ' ' CG1' ' A' ' 53' ' ' ILE . 8.3 tt0 -127.71 136.02 50.97 Favored 'General case' 0 C--N 1.351 0.655 0 CA-C-N 112.543 -2.117 . . . . 0.0 105.583 175.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.434 ' CE ' HG11 ' A' ' 27' ' ' VAL . 5.5 mtp -85.24 167.83 15.3 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 114.04 -1.436 . . . . 0.0 108.885 179.0 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 8.1 mtpt -155.0 93.18 2.77 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 117.464 -1.694 . . . . 0.0 111.519 178.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo . . . . . 0 C--N 1.364 1.379 0 C-N-CA 121.687 1.592 . . . . 0.0 108.556 173.746 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.222 -0.357 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 53.3 t -56.52 106.84 0.73 Allowed Pre-proline 0 CA--C 1.548 0.885 0 O-C-N 124.747 1.279 . . . . 0.0 109.033 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 7.5 Cg_exo -70.41 156.38 61.76 Favored 'Trans proline' 0 N--CA 1.443 -1.47 0 N-CA-C 117.063 1.909 . . . . 0.0 117.063 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -50.58 159.13 2.33 Favored 'Trans proline' 0 C--N 1.369 1.614 0 C-N-CA 122.07 1.847 . . . . 0.0 115.141 177.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -71.07 119.47 6.33 Favored 'Trans proline' 0 C--N 1.363 1.328 0 N-CA-C 104.394 -2.964 . . . . 0.0 104.394 176.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.418 ' CG1' ' HD2' ' B' ' 6' ' ' PRO . 5.4 t -62.85 148.85 91.12 Favored Pre-proline 0 CA--C 1.545 0.771 0 O-C-N 124.59 1.181 . . . . 0.0 108.39 -178.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . 0.418 ' HD2' ' CG1' ' B' ' 5' ' ' VAL . 12.3 Cg_exo -67.43 163.62 33.98 Favored 'Trans proline' 0 N--CA 1.443 -1.465 0 N-CA-C 115.778 1.415 . . . . 0.0 115.778 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_endo -71.62 119.42 6.22 Favored 'Trans proline' 0 C--N 1.364 1.372 0 O-C-N 124.633 1.86 . . . . 0.0 108.589 175.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.42 67.85 2.94 Favored 'General case' 0 C--N 1.353 0.726 0 CA-C-O 123.349 1.547 . . . . 0.0 109.167 178.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 165.1 84.56 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 110.447 -3.069 . . . . 0.0 106.104 -179.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -9.6 -63.68 0.0 OUTLIER 'General case' 0 C--N 1.352 0.678 0 CA-C-N 111.139 -2.755 . . . . 0.0 113.585 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.334 -0.085 0 CA-C-N 110.304 -3.134 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.586 ' CG ' ' H ' ' A' ' 2' ' ' GLU . 2.9 ttp . . . . . 0 N--CA 1.437 -1.118 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.586 ' H ' ' CG ' ' A' ' 1' ' ' MET . 15.3 pt-20 -6.64 -172.69 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.513 1 C-N-CA 133.929 4.892 . . . . 0.0 119.408 173.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.613 ' HA ' HD12 ' A' ' 53' ' ' ILE . . . 87.93 133.96 0.04 OUTLIER 'General case' 0 CA--C 1.554 1.104 2 C-N-CA 138.153 6.581 . . . . 0.0 109.764 178.696 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.629 HD13 ' HA ' ' A' ' 24' ' ' ILE . 11.4 mm -148.11 123.19 2.25 Favored 'Isoleucine or valine' 0 C--N 1.354 0.793 0 CA-C-N 109.04 -3.709 . . . . 0.0 106.391 -178.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.71 125.87 27.58 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.919 179.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -96.55 -22.89 16.8 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 113.119 -1.855 . . . . 0.0 114.215 -179.023 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 38.0 m-85 -142.22 168.87 18.72 Favored 'General case' 0 N--CA 1.481 1.087 0 O-C-N 124.807 1.317 . . . . 0.0 107.75 -179.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -68.0 146.63 53.37 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 118.17 -1.412 . . . . 0.0 107.832 177.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 34.7 t80 -145.69 128.78 16.59 Favored 'General case' 0 C--N 1.355 0.841 0 C-N-CA 117.385 -1.726 . . . . 0.0 108.967 176.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.21 102.09 9.28 Favored 'General case' 0 CA--C 1.558 1.281 0 CA-C-N 111.007 -2.815 . . . . 0.0 109.045 -178.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -47.05 170.02 0.01 OUTLIER 'General case' 0 C--N 1.382 1.996 0 CA-C-O 124.418 2.056 . . . . 0.0 113.28 -179.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . 0.306 44.2 p -123.92 -25.15 4.29 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 109.886 -3.324 . . . . 0.0 111.175 -177.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -153.05 172.75 16.39 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 117.81 -1.556 . . . . 0.0 112.259 -174.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.7 p30 -59.84 -25.47 65.04 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 110.99 -2.823 . . . . 0.0 113.931 -177.034 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -87.32 -7.66 57.55 Favored 'General case' 0 C--O 1.214 -0.771 0 C-N-CA 118.952 -1.099 . . . . 0.0 111.082 -178.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -111.24 162.82 14.58 Favored 'General case' 0 N--CA 1.478 0.93 0 CA-C-N 114.043 -1.435 . . . . 0.0 107.495 -178.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.626 HD23 ' N ' ' A' ' 46' ' ' GLY . 0.4 OUTLIER -138.08 156.84 47.37 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 113.827 -1.533 . . . . 0.0 109.029 178.316 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' SER . . . . . 0.569 ' O ' HD12 ' A' ' 17' ' ' LEU . 3.1 m -86.59 162.9 17.75 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-O 123.425 1.583 . . . . 0.0 115.191 -178.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -162.74 167.77 22.51 Favored 'General case' 0 C--N 1.356 0.854 0 CA-C-N 109.307 -3.588 . . . . 0.0 107.871 175.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -130.52 147.11 52.17 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 111.005 -2.816 . . . . 0.0 104.71 -179.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.9 ttt180 -43.04 99.49 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.707 0 O-C-N 125.835 1.96 . . . . 0.0 113.089 179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.89 -34.41 1.86 Allowed Glycine 0 C--N 1.351 1.389 0 CA-C-N 113.623 -1.626 . . . . 0.0 115.527 177.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 -45.85 151.82 0.42 Allowed 'General case' 0 C--N 1.359 1.016 0 N-CA-C 115.687 1.736 . . . . 0.0 115.687 -177.169 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.629 ' HA ' HD13 ' A' ' 4' ' ' ILE . 6.9 mt -100.62 121.66 51.67 Favored 'Isoleucine or valine' 0 C--N 1.35 0.622 0 N-CA-C 104.696 -2.335 . . . . 0.0 104.696 176.2 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.709 HD11 HD11 ' A' ' 41' ' ' LEU . 0.0 OUTLIER -106.86 140.96 38.86 Favored 'General case' 0 N--CA 1.438 -1.07 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 -179.003 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.02 110.91 23.0 Favored 'General case' 0 C--O 1.209 -1.069 2 CA-C-N 107.181 -4.554 . . . . 0.0 107.622 -179.173 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 1' ' ' MET . 3.5 m -88.05 115.58 28.56 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.25 0 C-N-CA 118.703 -1.199 . . . . 0.0 110.7 -176.256 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.74 -9.92 27.91 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-N 113.017 -1.901 . . . . 0.0 110.831 -179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 179.5 150.92 0.35 Allowed 'General case' 0 C--N 1.356 0.857 0 CA-C-N 115.426 -0.806 . . . . 0.0 108.982 -178.188 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.41 ' O ' ' HB3' ' A' ' 31' ' ' GLU . 1.9 pm0 -171.03 100.08 0.21 Allowed 'General case' 0 C--N 1.365 1.265 0 C-N-CA 117.173 -1.811 . . . . 0.0 111.746 -178.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.41 ' HB3' ' O ' ' A' ' 30' ' ' GLU . 12.6 pt-20 170.76 31.16 0.0 OUTLIER 'General case' 0 C--N 1.354 0.769 0 O-C-N 125.914 2.008 . . . . 0.0 112.64 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 15.3 p -74.09 -56.15 5.26 Favored 'General case' 0 C--N 1.349 0.573 0 CA-C-N 114.12 -1.4 . . . . 0.0 108.892 -179.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -160.85 48.83 0.23 Allowed 'General case' 0 CA--C 1.558 1.266 0 O-C-N 124.922 1.389 . . . . 0.0 113.53 -179.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 16.34 80.19 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 128.637 2.775 . . . . 0.0 113.578 177.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 63.7 m-20 172.46 -12.65 0.0 OUTLIER 'General case' 0 CA--C 1.56 1.354 0 C-N-CA 130.112 3.365 . . . . 0.0 110.763 -177.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 69.4 m95 -129.65 174.3 9.82 Favored 'General case' 0 CA--C 1.568 1.659 0 CA-C-O 121.8 0.809 . . . . 0.0 110.25 -179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -142.83 138.14 30.12 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 126.058 1.743 . . . . 0.0 107.145 174.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 10.6 tttm -100.2 114.87 28.61 Favored 'General case' 0 CA--C 1.55 0.978 0 N-CA-C 105.606 -1.998 . . . . 0.0 105.606 175.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -136.08 172.69 12.65 Favored 'General case' 0 C--N 1.364 1.229 0 C-N-CA 118.671 -1.212 . . . . 0.0 111.578 -175.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -112.6 145.46 40.33 Favored 'General case' 0 C--N 1.367 1.355 0 O-C-N 125.481 1.738 . . . . 0.0 110.53 -177.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.709 HD11 HD11 ' A' ' 25' ' ' LEU 0.295 4.4 mt -159.22 135.6 9.14 Favored 'General case' 0 C--N 1.361 1.104 0 CA-C-N 109.086 -3.688 . . . . 0.0 112.794 178.815 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER 54.87 28.43 10.43 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 112.431 -2.168 . . . . 0.0 114.971 170.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 72.37 29.14 66.59 Favored Glycine 0 CA--C 1.55 2.244 0 C-N-CA 119.775 -1.202 . . . . 0.0 114.067 -179.186 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 34.9 mttt -139.31 157.82 45.23 Favored 'General case' 0 C--N 1.35 0.613 0 C-N-CA 126.782 2.033 . . . . 0.0 107.711 177.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -139.73 142.28 36.83 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 105.643 -1.984 . . . . 0.0 105.643 -179.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.626 ' N ' HD23 ' A' ' 17' ' ' LEU . . . -176.95 173.62 46.44 Favored Glycine 0 CA--C 1.53 1.024 0 CA-C-N 113.542 -1.663 . . . . 0.0 110.874 -179.179 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -77.18 145.36 37.71 Favored 'General case' 0 CA--C 1.573 1.827 0 CA-C-O 122.834 1.302 . . . . 0.0 111.542 179.872 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.598 ' CD1' HD23 ' A' ' 25' ' ' LEU . 47.2 pt -143.73 143.89 25.11 Favored Pre-proline 0 C--N 1.355 0.827 0 CA-C-N 113.6 -1.636 . . . . 0.0 107.685 178.025 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.4 ' HG3' HG13 ' B' ' 5' ' ' VAL . 11.3 Cg_endo -73.06 144.91 38.66 Favored 'Trans proline' 0 C--N 1.346 0.447 0 N-CA-C 114.318 0.853 . . . . 0.0 114.318 -177.275 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.04 -40.79 71.48 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 115.071 -2.652 . . . . 0.0 111.985 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.453 HD22 ' HB2' ' B' ' 3' ' ' PRO . 10.5 p-10 -55.43 -19.39 9.15 Favored 'General case' 0 CA--C 1.562 1.411 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 177.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.6 m-85 -93.25 -4.39 51.96 Favored 'General case' 0 C--N 1.366 1.309 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 178.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.613 HD12 ' HA ' ' A' ' 3' ' ' ALA . 0.4 OUTLIER -129.25 176.92 7.19 Favored 'Isoleucine or valine' 0 C--N 1.351 0.665 0 CA-C-O 122.991 1.377 . . . . 0.0 111.216 -179.412 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -132.32 138.53 47.83 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 110.807 -2.906 . . . . 0.0 104.942 177.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.42 ' O ' ' HD3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -89.34 141.8 28.22 Favored 'General case' 0 C--N 1.35 0.611 0 O-C-N 124.25 0.969 . . . . 0.0 111.691 176.834 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 28.6 mmmt -97.07 92.42 1.17 Allowed Pre-proline 0 CA--C 1.583 2.222 0 O-C-N 124.196 0.935 . . . . 0.0 110.96 171.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.42 ' HD3' ' O ' ' A' ' 55' ' ' MET . 12.4 Cg_endo . . . . . 0 C--N 1.381 2.281 0 C-N-CA 122.946 2.43 . . . . 0.0 111.381 176.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 0' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.225 -0.233 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' VAL . . . . . . . . . . . . . 7.4 p 23.09 117.91 0.0 OUTLIER Pre-proline 0 C--N 1.352 0.714 0 C-N-CA 128.276 2.63 . . . . 0.0 112.415 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -73.03 153.48 52.29 Favored 'Trans proline' 0 N--CA 1.44 -1.645 0 C-N-CA 117.541 -1.173 . . . . 0.0 114.378 176.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.453 ' HB2' HD22 ' A' ' 51' ' ' ASN . 74.2 Cg_exo -51.79 162.09 1.89 Allowed 'Trans proline' 0 C--N 1.367 1.51 0 C-N-CA 122.602 2.201 . . . . 0.0 115.577 177.129 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_endo -82.96 109.28 1.69 Allowed 'Trans proline' 0 CA--C 1.539 0.75 0 N-CA-C 105.931 -2.373 . . . . 0.0 105.931 175.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.461 HG12 ' HD2' ' B' ' 6' ' ' PRO . 2.5 t -49.1 148.05 4.48 Favored Pre-proline 0 CA--C 1.56 1.353 0 CA-C-N 113.563 -1.653 . . . . 0.0 111.802 -177.637 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' PRO . . . . . 0.461 ' HD2' HG12 ' B' ' 5' ' ' VAL . 26.8 Cg_exo -67.3 153.98 75.46 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 123.06 2.506 . . . . 0.0 115.689 178.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_endo -65.85 114.35 2.92 Favored 'Trans proline' 0 C--N 1.372 1.794 0 N-CA-C 107.106 -1.921 . . . . 0.0 107.106 175.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -95.25 93.42 7.28 Favored 'General case' 0 C--O 1.22 -0.482 0 N-CA-C 104.601 -2.37 . . . . 0.0 104.601 179.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 151.95 79.05 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 O-C-N 125.776 1.923 . . . . 0.0 108.719 -177.035 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -77.27 73.72 3.85 Favored 'General case' 0 CA--C 1.551 0.999 0 CA-C-N 111.52 -2.582 . . . . 0.0 110.987 178.47 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.336 0.006 0 CA-C-N 115.198 -0.91 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_